Thiourea-¹³C - ≥99 atom% 13C,≥98% , CAS No.113899-66-4

CAS: 113899-66-4 Cat. No.: T345544 Molecular Weight: 77.11 EC Number: 623-950-3 PubChem CID: 12201089
AVAILABLE TO ORDER
GRADE & PURITY ≥99 atom% ¹³C,≥98%
Synonyms
J-003039 | AKOS015898388 | Thiourea-13C, 99 atom % 13C | diamino(113C)methanethione | DTXSID80480200 | Thiourea-13C
Storage
Protected from light,Argon charged,Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
100mg
T345544-100mg
1

$742.90

$868.90
Save $126.00 (14.50%)
25mg
T345544-25mg
3

$285.90

$334.90
Save $49.00 (14.63%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥99 atom% 13C,≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Argon charged,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
J-003039 | AKOS015898388 | Thiourea-13C, 99 atom % 13C | diamino(113C)methanethione | DTXSID80480200 | Thiourea-13C
Specifications & Purity
≥99 atom% 13C, ≥98%
Storage
Protected from light, Argon charged, Room temperature
Shipped In
Normal
Purity
≥99 atom% ¹³C, ≥98%
Names and Identifiers
Pubchem Sid488197933
Canonical SmilesC(=S)(N)N
IUPAC Namediamino(113C)methanethione
InChIKeyUMGDCJDMYOKAJW-OUBTZVSYSA-N
INCHI1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)/i1+1
Isomeric SMILES [13C](=S)(N)N
PubChem CID 12201089
Molecular Weight 77.11

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 Organonitrogen compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Thiourea - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic 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





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.

4 results found

Lot NumberCertificate TypeDateItem
F23101256Certificate of AnalysisMar 16, 2026 T345544
F23101322Certificate of AnalysisMar 16, 2026 T345544
F23101323Certificate of AnalysisMar 16, 2026 T345544
F23101324Certificate of AnalysisMar 16, 2026 T345544
Chemical and Physical Properties
SensitivityMoisture sensitive;light sensitive
Melt Point(°C)170-176℃
Molecular Weight77.120 g/mol
XLogP3-0.800
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass77.0129 Da
Monoisotopic Mass77.0129 Da
Topological Polar Surface Area84.100 Ų
Heavy Atom Count4
Formal Charge0
Complexity29.000
Isotope Atom Count1
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
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