Basic information
- CAS
617-38-9- Standard SMILES
CCSC(=S)N(C)C- InChIKey
VPNCITAAFMVUKG-UHFFFAOYSA-N- Molecular formula
- C5H11NS2
- Average molar mass
- 149.3 g/mol
- Monoisotopic mass
- 149.0332917
Names & identifiers
- Preferred name
- Carbamodithioic acid, dimethyl-, ethyl ester
- IUPAC
- ethyl N,N-dimethylcarbamodithioate
- English name
- Dimethyldithiocarbamic acid ethyl ester
- Molecular formula
- C5H11NS2
- Molecular weight
- 149.28
Names & synonyms
617-38-9CARBAMIC ACID, DIMETHYLDITHIO-, ETHYL ESTERCarbamodithioic acid, dimethyl-, ethyl esterDTXSID70210699RefChem:1081014DTXCID50133190Preparation 23Ethyl dimethyldithiocarbamateEthyl dimethylcarbamodithioateEthyl ester of dimethyldithiocarbamic acidBRN 1744918Dimethyldithiocarbamic acid ethyl ester
Show more names
ethyl N,N-dimethyldithiocarbamateN,N-Dimethyldithiocarbamic acid ethyl esterCarbamodithioic acid, dimethyl-, ethyl ester (9CI)
SCHEMBL677364SCHEMBL8411967SCHEMBL8411971VPNCITAAFMVUKG-UHFFFAOYSA-NS-Ethyl-N,N-dimethyldithiocarbamateCarbamodithioic acid, N,N-dimethyl-, ethyl ester
Database identifiers
- CAS
617-38-9- PubChem CID
- 12042
- DTXSID
DTXSID70210699- Nikkaji
- J13.678F
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 60.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 80.5
Physicochemical properties
- Density
- 1.079 · 1.079 (estimate)
- refractive index
- 1.53 · 1.5300 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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