1,3-Dicyclohexylthiourea - ≥98%(N) , CAS No.1212-29-9

CAS: 1212-29-9 Cat. No.: D154879 Molecular Weight: 240.41 EC Number: 214-920-7
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(N)
Synonyms
Tox21_201806 | Tox21_302838 | NCGC00256322-01 | Oprea1_850375 | NSC33443 | NSC-33443 | D89654 | NCGC00090801-01 | Q27269587 | Thiourea,N'-dicyclohexyl- | FT-0629385 | 3-12-00-00049 (Beilstein Handbook Reference) | Urea,3-dicyclohexyl-2-thio- | UNII-854CTM
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
D154879-1g
5
$9.90
5g
D154879-5g
4
$15.90
25g
D154879-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$35.90
100g
D154879-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$129.90
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Room temperature Ships Normal 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Tox21_201806 | Tox21_302838 | NCGC00256322-01 | Oprea1_850375 | NSC33443 | NSC-33443 | D89654 | NCGC00090801-01 | Q27269587 | Thiourea, N'-dicyclohexyl- | FT-0629385 | 3-12-00-00049 (Beilstein Handbook Reference) | Urea, 3-dicyclohexyl-2-thio- | UNII-854CTM
Specifications & Purity
≥98%(N)
Storage
Room temperature
Shipped In
Normal
Purity
≥98%(N)
Names and Identifiers
Pubchem Sid488191274
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488191274
Canonical SmilesC1CCC(CC1)NC(=S)NC2CCCCC2
IUPAC Name1,3-dicyclohexylthiourea
InChIKeyKAJICSGLHKRDLN-UHFFFAOYSA-N
INCHI1S/C13H24N2S/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)
Isomeric SMILES C1CCC(CC1)NC(=S)NC2CCCCC2
RTECS YS9300000
UN Number 2811
Packing Group I
Molecular Weight 240.41
Reaxy-Rn 517587
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=517587&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
SuperclassOrganosulfur compounds
ClassThioureas
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentThioureas
Alternative Parents Organopnictogen compounds  Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic homomonocyclic compounds
Substituents Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as thioureas. These are organic compounds containing the thiourea functional group, a derivative of urea with the general structure (R1(N)R2C(=S)(R3)R4, R1-R4=H, alkyl, aryl), obtained by replacing the carbonyl group of urea with a thiocarbonyl group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
AR Tclin Androgen Receptor (11781 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TP53 Tchem Cellular tumor antigen p53 (48468 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
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.

3 results found

Lot NumberCertificate TypeDateItem
A2104256Certificate of AnalysisOct 12, 2024 D154879
A2104255Certificate of AnalysisOct 12, 2024 D154879
A2104254Certificate of AnalysisOct 12, 2024 D154879
Chemical and Physical Properties
SensitivityMoisture sensitive
Melt Point(°C)181 °C
Molecular Weight240.410 g/mol
XLogP33.600
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass240.166 Da
Monoisotopic Mass240.166 Da
Topological Polar Surface Area56.200 Ų
Heavy Atom Count16
Formal Charge0
Complexity196.000
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
Solution Calculators
Reviews

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