Carbamothioic acid, diethyl-

Substructure search Find similar structures

Basic information

CAS: 19045-48-8
Standard SMILES: CCN(CC)C(=O)S
InChIKey: UAGGVDVXSRGPRP-UHFFFAOYSA-N
Molecular formula: C5H11NOS
Average molar mass: 133.21 g/mol
Monoisotopic mass: 133.05613515

Overview

See also: Diethylcarbamothioic acid (annotation moved to).

Names & identifiers

Preferred name: Carbamothioic acid, diethyl-
IUPAC: diethylcarbamothioic S-acid
English name: Diethylthiocarbamicacid
Molecular weight: 0

Names & synonyms

Carbamothioic acid, diethyl-diethylcarbamothioic S-acid19045-48-8Diethylthiocarbamatediethylthiocarbamic acidSCHEMBL689388SCHEMBL689389SCHEMBL689791SCHEMBL689792DTXSID10172525DiethylthiocarbamicacidN,N-Diethylthiocarbamic acid

Database identifiers

CAS: 19045-48-8
PubChem CID: 146472
DTXSID: DTXSID10172525
Nikkaji: J23.399D

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 21.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 2
Heavy atoms: 8
Formal charge: 0
Complexity: 80.5

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…