CID 3075011

Base Information

• Chemical Name: CID 3075011
• CAS No.: 171088-71-4
• Molecular Formula: C14H19N3O3S
• Molecular Weight: 309.38396
• DSSTox Substance ID: DTXSID60169001
• Mol file: 171088-71-4.mol

Synonyms:171088-71-4;4,5-dihydro-1,3-thiazol-2-amine;4-(2-methylanilino)-4-oxobutanoic acid;DTXSID60169001;BOBZJEDZBZZMOC-UHFFFAOYSA-N;C11H13NO3.C3H6N2S;LS-46363

Chemical Property of CID 3075011

Chemical Property:

• Vapor Pressure: 1.58E-08mmHg at 25°C
• Boiling Point: 440.2°C at 760 mmHg
• Flash Point: 220.1°C
• PSA: 131.07000
• LogP: 3.13390
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 309.11471265
• Heavy Atom Count: 21
• Complexity: 319

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1NC(=O)CCC(=O)O.C1CSC(=N1)N