Propylthiourea - ≥98% , CAS No.927-67-3

CAS: 927-67-3 Cat. No.: P356262 Fórmula: C₄H₁₀N₂S Peso molecular: 118.2 Número CE: 213-158-2 PubChem CID: 1615208

GRADE & PURITY ≥98%

Synonyms

D86341 | NCGC00341605-01 | MFCD00041195 | CHEBI:180509 | Thiourea, propyl- | 1-propylthiourea | Thiourea,N-propyl- | 3-(1-Thioureido)propyl, functionalized silica gel, 200-400 mesh, extent of labeling: 1.1 mmol/g loading | EN300-08482 | DTXSID20239113 | P

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

D86341 | NCGC00341605-01 | MFCD00041195 | CHEBI:180509 | Thiourea, propyl- | 1-propylthiourea | Thiourea,N-propyl- | 3-(1-Thioureido)propyl, functionalized silica gel, 200-400 mesh, extent of labeling: 1.1 mmol/g loading | EN300-08482 | DTXSID20239113 | P

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 488191977
• Sorrisos canónicos: CCCNC(=S)N
• IUPAC Name: propylthiourea
• InChIKey: UHGKYJXJYJWDAM-UHFFFAOYSA-N
• INCHI: 1S/C4H10N2S/c1-2-3-6-4(5)7/h2-3H2,1H3,(H3,5,6,7)
• SMILES isoméricas: CCCNC(=S)N
• PubChem CID: 1615208
• Número UN: 2811
• Grupo de embalagem: III
• Peso molecular: 118.2

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Classe Thioureas

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Classe: Thioureas
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Thioureas
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound
• Descrição: This 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

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Ponto de fusão (°C): 109-112° C
• Peso molecular: 118.200 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 118.056 Da
• Monoisotopic Mass: 118.056 Da
• Topological Polar Surface Area: 70.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 62.700
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 927-67-3, the molecular formula is C4H10N2S, and the molecular weight is 118.2 g/mol. InChIKey UHGKYJXJYJWDAM-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.