2,3-Dihydro-2,2-dimethyl-7-benzofuranyl carbamate
Basic information
- CAS
4790-87-8- Standard SMILES
CC1(C)Cc2cccc(OC(N)=O)c2O1- InChIKey
QTBBEJJXBYGFAP-UHFFFAOYSA-N- Molecular formula
- C11H13NO3
- Average molar mass
- 207.23 g/mol
- Monoisotopic mass
- 207.08954328
Names & identifiers
- Preferred name
- 2,3-Dihydro-2,2-dimethyl-7-benzofuranyl carbamate
- IUPAC
- (2,2-dimethyl-3H-1-benzofuran-7-yl) carbamate
Names & synonyms
4790-87-8NSC 1678187-BENZOFURANOL, 2,3-DIHYDRO-2,2-DIMETHYL-, CARBAMATE (ester)RDX428D787UNII-RDX428D7872,2-Dimethyl-2,3-dihydro-7-benzofuranyl carbamateCarbamic acid, 2,2-dimethyl-2,3-dihydro-7-benzofuranyl esterNSC-1678182,3-Dihydro-2,2-dimethyl-7-benzofuranyl carbamateDTXSID90197332Carbamic acid, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester7-BENZOFURANOL, 2,3-DIHYDRO-2,2-DIMETHYL-, 7-CARBAMATE
Show more names
7-BENZOFURANOL, 2,3-DIHYDRO-2,2-DIMETHYL-, CARBAMATERefChem:197331DTXCID00119823NSC1678182,2-Dimethyl-2,3-dihydro-1-benzofuran-7-yl carbamateSCHEMBL109966482,2-Dimethyl-2,3-dihydro-1-benzo[b]furan-7-yl carbamate2,3-dihydro-2,2-dimethylbenzofuran-7-yl carbamate
Database identifiers
- CAS
4790-87-8- PubChem CID
- 20923
- DTXSID
DTXSID90197332- UNII
- RDX428D787
- Nikkaji
- J71.559J
Properties
Computed structural properties
- XLogP
- 1.9
- 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
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Compound notes
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