Basic information
- CAS
52098-86-9- Standard SMILES
NCCCNC(=S)S- InChIKey
GQBWSMXMWZAPDM-UHFFFAOYSA-N- Molecular formula
- C4H10N2S2
- Average molar mass
- 150.3 g/mol
- Monoisotopic mass
- 150.02854067
Names & identifiers
- Preferred name
- Carbamodithioic acid, (3-aminopropoyl)-
- IUPAC
- 3-aminopropylcarbamodithioic acid
Names & synonyms
52098-86-9Carbamodithioic acid, (3-aminopropoyl)-RefChem:1081002(3-Aminopropyl)carbamodithioic acidCarbamic acid, (3-aminopropyl)dithio-BRN 1749751Acide amino-3 (n-propyl)-dithiocarbamique [French]SCHEMBL11776641DTXSID60966456(3-Aminopropyl)carbonimidodithioic acidAcide amino-3 (n-propyl)-dithiocarbamique4-04-00-01269 (Beilstein Handbook Reference)
Database identifiers
- CAS
52098-86-9- PubChem CID
- 3040366
- DTXSID
DTXSID60966456
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 74.4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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