Basic information
- CAS
100347-64-6- Standard SMILES
CC1(C)Cc2c(OC(N)=O)cccc2O1- InChIKey
QWMCXKPUWNTGIZ-UHFFFAOYSA-N- Molecular formula
- C11H13NO3
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.08954328
Names & identifiers
- Preferred name
- 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate
- IUPAC
- (2,2-dimethyl-3H-1-benzofuran-4-yl) carbamate
Names & synonyms
4-BENZOFURANOL, 2,3-DIHYDRO-2,2-DIMETHYL-, CARBAMATE100347-64-62,2-Dimethyl-2,3-dihydro-4-benzofuranyl carbamateDTXSID90143213RefChem:290243DTXCID7065704NSC1676802,2-dimethyl-2,3-dihydro-1-benzofuran-4-yl carbamateNSC-167680
Database identifiers
- CAS
100347-64-6- PubChem CID
- 57802
- DTXSID
DTXSID90143213
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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