Basic information
- CAS
27445-19-8- Standard SMILES
CNC(=O)Oc1cccc2c1CC(C)(C)C2- InChIKey
KPBGZJBRWUVQCZ-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- 2,2-Dimethyl-2,3-dihydro-1H-inden-4-yl hydrogen methylcarbonimidate
- IUPAC
- (2,2-dimethyl-1,3-dihydroinden-4-yl) N-methylcarbamate
Names & synonyms
27445-19-8DTXSID509501222,2-Dimethyl-2,3-dihydro-1H-inden-4-yl hydrogen methylcarbonimidateRefChem:1059117DTXCID101378289BRN 18781182,3-Dihydro-2,2-dimethyl-1H-inden-4-ol methylcarbamate1H-Inden-4-ol, 2,3-dihydro-2,2-dimethyl-, methylcarbamate
Database identifiers
- CAS
27445-19-8- PubChem CID
- 213974
- DTXSID
DTXSID50950122
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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