Ent 27086
Basic information
- CAS
1631-64-7- Standard SMILES
CNC(=O)ON=C1SCCS1- InChIKey
PTWXDEFRSGIDOE-UHFFFAOYSA-N- Molecular formula
- C5H8N2O2S2
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.00271985
Names & identifiers
- Preferred name
- Ent 27086
- IUPAC
- (1,3-dithiolan-2-ylideneamino) N-methylcarbamate
Names & synonyms
1,3-Dithiolan-2-one, O-((methylamino)carbonyl)oximeAmerican cyanamid EI-38906OMS 744ENT 27,086CL 38906AC 38,906AI3-27086E.I. 38,906ENT 27086Imidocarbonic acid, ((methylcarbamoyl)oxy)dithio-, cyclic ethylene esterDTXSID5075105CARBONIC ACID, DITHIO-, cyclic S,S-ETHYLENE ESTER, O-(METHYLCARBAMOYL)OXIME
Show more names
1,3-Dithiolan-2-one O-((methylamino)carbonyl)oxime1,3-Dithiolan-2-one O-[(methylamino)carbonyl]oximeRefChem:339605DTXCID00352411631-64-7(1,3-dithiolan-2-ylideneamino) N-methylcarbamateENT-270861,3-Dithiolan-2-one O-methylcarbamoyl oxime
Database identifiers
- CAS
1631-64-7- PubChem CID
- 15403
- DTXSID
DTXSID5075105
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 175
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…