Basic information
- CAS
4790-88-9- Standard SMILES
CN(C)C(=O)Oc1cccc2c1OC(C)(C)C2- InChIKey
MITWTLRVHJJPSO-UHFFFAOYSA-N- Molecular formula
- C13H17NO3
- Average molar mass
- 235.28 g/mol
- Monoisotopic mass
- 235.1208434
Names & identifiers
- Preferred name
- 7-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, dimethylcarbamate
- IUPAC
- (2,2-dimethyl-3H-1-benzofuran-7-yl) N,N-dimethylcarbamate
Names & synonyms
4790-88-97-BENZOFURANOL, 2,3-DIHYDRO-2,2-DIMETHYL-, DIMETHYLCARBAMATE2,2-Dimethyl-2,3-dihydro-7-benzofuranyl-N,N-dimethylcarbamateDTXSID50197333Carbamic acid, dimethyl-, 2,2-dimethyl-2,3-dihydro-7-benzofuranyl esterRefChem:310313DTXCID601198242,2-Dimethyl-2,3-dihydro-1-benzo[b]furan-7-yl dimethylcarbamate2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl dimethylcarbamate
Database identifiers
- CAS
4790-88-9- PubChem CID
- 20924
- DTXSID
DTXSID50197333
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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