Isotiocianato di fenile(PITC) - ≥98% , CAS No.103-72-0

CAS: 103-72-0 Cat. No.: P110634 Formula: C6H5NCS Peso molecolare: 135.19 Beilstein Registry Number: 471392 Numero EC: 203-138-1
Disponibile su ordine
GRADE & PURITY ≥98%
Synonyms
Estere fenilico dell'acido isotiocianico
Storage
Conservare a 2-8°C, con carica di argon
Shipped In
Ghiaccio umido
★
Size
Germania (EU)
USA*
Price
Qty
25ml
P110634-25ml
—
Disponibile ≥10
25,95€
100ml
P110634-100ml
—
3 Disponibile
86,69€
500ml
P110634-500ml
—
1 Disponibile
312,30€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Conservare a 2-8°C, con carica di argon Ships Ghiaccio umido 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 38 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Panoramica

L'isotiocianato di fenile è un isotiocianato aromatico. Partecipa alle reazioni di disidratazione degli alcoli. È ampiamente utilizzato per la sintesi di vari composti eterociclici biologicamente importanti.
Inibisce la tumorigenesi indotta da NNK.

Specifications

Sinonimi
Estere fenilico dell'acido isotiocianico
Specifiche e purezza
≥98%
Condizioni di conservazione di stoccaggio
Conservare a 2-8°C, con carica di argon
Spedito in
Ghiaccio umido
Purezza
≥98%
Nomi e identificatori
Pubchem Sid508813506
Sorrisi canoniciC1=CC=C(C=C1)N=C=S
IUPAC Nameisothiocyanatobenzene
InChIKeyQKFJKGMPGYROCL-UHFFFAOYSA-N
INCHI1S/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5H
Isomeri SMILES C1=CC=C(C=C1)N=C=S
WGK Germania 3
RTECS NX9275000
Numero UN 2927
Gruppo di imballaggio II
Peso molecolare 135.19
Beilstein 471392
Reaxy-Rn 471392
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=471392&ln=

Documentazione

📋 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
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzene and substituted derivatives
Alternative Parents Isothiocyanates  Propargyl-type 1,3-dipolar organic compounds  Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Monocyclic benzene moiety - Isothiocyanate - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
External Descriptors isothiocyanate
Struttura 3D
Modello di struttura chimica interattiva





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TP53 Tchem Cellular tumor antigen p53 (48468 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Obiettivi associati (non umani)
Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Sclerotinia sclerotiorum (877 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Meccanismi d'azione
Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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.

33 results found

Lot NumberCertificate TypeDataOggetto
C2606440Certificate of AnalysisFeb 26, 2026 P110634
C2606442Certificate of AnalysisFeb 26, 2026 P110634
C2606443Certificate of AnalysisFeb 26, 2026 P110634
J2516777Certificate of AnalysisOct 10, 2025 P110634
J2516776Certificate of AnalysisOct 10, 2025 P110634
J2516763Certificate of AnalysisOct 10, 2025 P110634
E2125204Certificate of AnalysisMar 04, 2025 P110634
D2515465Certificate of AnalysisFeb 20, 2025 P110634
D2515434Certificate of AnalysisFeb 20, 2025 P110634
D2515464Certificate of AnalysisFeb 20, 2025 P110634
L2403334Certificate of AnalysisNov 13, 2024 P110634
L2403275Certificate of AnalysisNov 13, 2024 P110634
J2409627Certificate of AnalysisSep 21, 2024 P110634
J2409618Certificate of AnalysisSep 21, 2024 P110634
J2409617Certificate of AnalysisSep 21, 2024 P110634
I2523544Certificate of AnalysisJul 12, 2024 P110634
E2408363Certificate of AnalysisApr 10, 2024 P110634
E2408359Certificate of AnalysisApr 10, 2024 P110634
E2408358Certificate of AnalysisApr 10, 2024 P110634
E2408352Certificate of AnalysisApr 10, 2024 P110634
K2303406Certificate of AnalysisOct 26, 2023 P110634
K2303407Certificate of AnalysisOct 26, 2023 P110634
K2303408Certificate of AnalysisOct 26, 2023 P110634
G2310762Certificate of AnalysisJun 14, 2023 P110634
G2310763Certificate of AnalysisJun 14, 2023 P110634
G2310764Certificate of AnalysisJun 14, 2023 P110634
C2302971Certificate of AnalysisJan 02, 2023 P110634
C2302970Certificate of AnalysisJan 02, 2023 P110634
C23021074Certificate of AnalysisJan 02, 2023 P110634
B2218540Certificate of AnalysisDec 08, 2021 P110634
K2217202Certificate of AnalysisDec 08, 2021 P110634
B2218545Certificate of AnalysisDec 08, 2021 P110634
B2218543Certificate of AnalysisDec 08, 2021 P110634
Proprietà chimiche e fisiche
SolubilitàSoluble in alcohol, and ether. Insoluble in water.
SensibilitàHeat & Moisture sensitive
Indice di rifrazione1.64918
Punto di infiammabilità (°F)190.4 °F
Punto di infiammabilità (°C)87℃
Punto di ebollizione (°C)221°C
Punto di fusione (°C)-21°C
Peso molecolare135.190 g/mol
XLogP33.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass135.014 Da
Monoisotopic Mass135.014 Da
Topological Polar Surface Area44.500 Ų
Heavy Atom Count9
Formal Charge0
Complexity121.000
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 Count1
Domande frequenti e articoli
Citations of This Product
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

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