6-Mercaptopurine monohydrate - ≥99.5% , DNA inhibitor, CAS No.6112-76-1, DNA inhibitor

CAS: 6112-76-1 Cat. No.: M111819 Peso molecular: 170.19 Beilstein Registry Number: 4012091 Número EC: 612-090-4
Disponible para pedir
GRADE & PURITY ≥99.5%
Synonyms
6,7-dihydro-3H-purine-6-thione hydrate | M-2690 | MERCAPTOPURINE [WHO-DD] | HMS2233O12 | MERCAPTOPURINE HYDRATE [JAN] | Q27114691 | 6-Mercaptopurine (6-MP) Monohydrate | 7H-purine-6-thiol hydrate | MERCAPTOPURINE [ORANGE BOOK] | Mercaptopurine, British Ph
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
M111819-1g
10
20,90US$
5g
M111819-5g
8
59,90US$
25g
M111819-25g
6
269,90US$
100g
M111819-100g
4
1.044,90US$
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥99.5% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 5 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Descripción general

6-Mercaptopurine is a widely used antileukemic agent that inhibits de novo purine synthesis through incorporation of thiopurine methyltransferase metabolites into DNA and RNA.

Specifications

Sinónimos
6, 7-dihydro-3H-purine-6-thione hydrate | M-2690 | MERCAPTOPURINE [WHO-DD] | HMS2233O12 | MERCAPTOPURINE HYDRATE [JAN] | Q27114691 | 6-Mercaptopurine (6-MP) Monohydrate | 7H-purine-6-thiol hydrate | MERCAPTOPURINE [ORANGE BOOK] | Mercaptopurine, British Ph
Especificaciones y pureza
≥99.5%
Mecanismos bioquímicos y fisiológicos
6-Mercaptopurine Monohydrate is an anti-inflammatory agent that has antitumor activity.6-Mercaptopurine Monohydrate is an antimetabolite of hypoxanthine. It is also an antitumor agent and induces apoptosis.An antimetabolite of hypoxanthine. Antitumor agen
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Tipo de acción
INHIBITOR
Mecanismo de acción
DNA inhibitor
Nota
Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Pureza
≥99.5%
Nombres e identificadores
Pubchem Sid488192268
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488192268
Sonrisas canónicasC1=NC2=C(N1)C(=S)N=CN2.O
IUPAC Name3,7-dihydropurine-6-thione;hydrate
InChIKeyWFFQYWAAEWLHJC-UHFFFAOYSA-N
INCHI1S/C5H4N4S.H2O/c10-5-3-4(7-1-6-3)8-2-9-5;/h1-2H,(H2,6,7,8,9,10);1H2
Isómeros SMILES C1=NC2=C(N1)C(=S)N=CN2.O
WGK Alemania 3
RTECS UP0400000
Número ONU 2811
Grupo de embalaje I
Peso molecular 170.19
Beilstein 4012091
Reaxy-Rn 30154736
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=30154736&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseImidazopyrimidines
SubclassPurines and purine derivatives
Intermediate Tree Nodes Not available
Direct ParentPurinethiones
Alternative Parents Pyrimidinethiones  Imidazoles  Heteroaromatic compounds  Azacyclic compounds  Organosulfur compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Purinethione - Pyrimidinethione - Pyrimidine - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as purinethiones. These are purines in which the purine moiety bears a thioketone.
External Descriptors hydrate
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ERG Tbio Transcriptional regulator ERG (5589 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GMNN Tbio Geminin (128009 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
BAZ2B Tchem Bromodomain adjacent to zinc finger domain protein 2B (56204 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ATXN2 Tbio Ataxin-2 (54410 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
RGS4 Tchem Regulator of G-protein signaling 4 (13867 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
IDH1 Tclin Isocitrate dehydrogenase [NADP] cytoplasmic (40980 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Plasmodium falciparum (966862 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

13 results found

Lot NumberCertificate TypeFechaArticulo
K1823090Certificate of AnalysisJun 10, 2026 M111819
K1823086Certificate of AnalysisJun 10, 2026 M111819
D1823074Certificate of AnalysisMay 21, 2025 M111819
D1823073Certificate of AnalysisMay 21, 2025 M111819
L1522135Certificate of AnalysisAug 01, 2023 M111819
E2306543Certificate of AnalysisSep 17, 2022 M111819
E2306554Certificate of AnalysisSep 17, 2022 M111819
E2306686Certificate of AnalysisSep 17, 2022 M111819
E2306689Certificate of AnalysisSep 17, 2022 M111819
E2306698Certificate of AnalysisSep 17, 2022 M111819
E2306705Certificate of AnalysisSep 17, 2022 M111819
E2306708Certificate of AnalysisSep 17, 2022 M111819
E2306549Certificate of AnalysisJul 28, 2022 M111819

Show more ⌵

Propiedades químicas y físicas
SolubilidadSoluble in dilute solutions of alkali hydroxides, hot alcohol, and 1 N NaOH (50 mg/ml). Insoluble in water.
Índice de refracción1.94
Punto de fusión (°C)313°C
Peso molecular170.200 g/mol
XLogP3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass170.026 Da
Monoisotopic Mass170.026 Da
Topological Polar Surface Area86.200 Ų
Heavy Atom Count11
Formal Charge0
Complexity190.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Preguntas frecuentes y artículos
Citations of This Product
Referencias
1. Mingyue Chang, Moru Zhang, Haihong Hu, Shucai Liang.  (2022)  Highly selective fluorescence detection of Pt4+ over Pd2+ and Pt2+ using a polyethyleneimine-based nanosensor prepared via facile three-component reaction.  SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY,      [PMID:35696970] [10.1016/j.saa.2022.121466]
2. Kai-Yuan Huang, Hong-Xing He, Shao-Bin He, Xiang-Ping Zhang, Hua-Ping Peng, Zhen Lin, Hao-Hua Deng, Xing-Hua Xia, Wei Chen.  (2019)  Gold nanocluster-based fluorescence turn-off probe for sensing of doxorubicin by photoinduced electron transfer.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2019.126656]
3. Xin Jiang, Qinqin Sang, Ming Yang, Juan Du, Weie Wang, Libin Yang, Xiaoxia Han, Bing Zhao.  (2019)  Metal-free SERS substrate based on rGO–TiO2–Fe3O4 nanohybrid: contribution from interfacial charge transfer and magnetic controllability.  PHYSICAL CHEMISTRY CHEMICAL PHYSICS,  21  (24): (12850-12858).  [PMID:31179479] [10.1039/C9CP02160D]
4. Yao Chen, Zeng-Ping Chen, Qi Zuo, Cai-Xia Shi, Ru-Qin Yu.  (2015)  Surface-enhanced Raman spectroscopy based on conical holed enhancing substrates.  ANALYTICA CHIMICA ACTA,      [PMID:26320784] [10.1016/j.aca.2015.07.025]
5. Xiupei Yang, Ling Jiang, Baowen Zhang, Jie Hu, Xiaoyan Cui, Qian Zhang.  (2025)  Ratiometric fluorescent probe for continuous detection of copper ions and lipoic acid in spinach using gold-silver bimetallic nanoclusters grown in situ on Zn MOF.  TALANTA,      [PMID:40349659] [10.1016/j.talanta.2025.128304]
Calculadoras de soluciones
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