Basic information
- CAS
55285-04-6- Standard SMILES
CN(C)SN(C)C(=O)Oc1cccc2c1OC(C)(C)C2- InChIKey
XUAAXZOIOGLBDP-UHFFFAOYSA-N- Molecular formula
- C14H20N2O3S
- Average molar mass
- 296.39 g/mol
- Monoisotopic mass
- 296.1194635
Names & identifiers
- Preferred name
- Carbamic acid, N-(dimethylamino)thio-N-methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester
- IUPAC
- (2,2-dimethyl-3H-1-benzofuran-7-yl) N-(dimethylaminosulfanyl)-N-methylcarbamate
Names & synonyms
N-(Dimethylaminosulfenyl)carbofuranCarbamic acid, N-(dimethylamino)thio-N-methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester55285-04-6DTXSID102037872,3-Dihydro-2,2-dimethyl-7-benzofuranyl-N-(N',N'-dimethylaminosulfenyl)-N-methylcarbamateN-(Dimethylamino)thio-N-methylcarbamic acid 2,3-dihydro-2,2-dimethyl-7-benzofuranyl esterRefChem:332674DTXCID40126278SCHEMBL10483521XUAAXZOIOGLBDP-UHFFFAOYSA-N2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-yl [(dimethylamino)sulfanyl](methyl)carbamate2,3-dihydro-2,2-dimethyl-7-benzofuranyl (dimethylaminosulfenyl)(methyl)carbamate
Database identifiers
- CAS
55285-04-6- PubChem CID
- 41382
- DTXSID
DTXSID10203787- Nikkaji
- J67.580F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 67.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 362
Related reactions
2 records
Compound notes
Loading…