Anthranilic acid, N-bicyclo(3.1.0)hex-3-yl-
Basic information
- CAS
79531-64-9- Standard SMILES
O=C(O)c1ccccc1NC1CC2CC2C1- InChIKey
OLRMMEZILYICNH-UHFFFAOYSA-N- Molecular formula
- C13H15NO2
- Average molar mass
- 217.26 g/mol
- Monoisotopic mass
- 217.11027872
Names & identifiers
- Preferred name
- Anthranilic acid, N-bicyclo(3.1.0)hex-3-yl-
- IUPAC
- 2-(3-bicyclo[3.1.0]hexanylamino)benzoic acid
Names & synonyms
BRN 5525100N-Bicyclo(3.1.0)hex-3-yl-anthranilic acid79531-64-9ANTHRANILIC ACID, N-BICYCLO(3.1.0)HEX-3-YL-RefChem:319853DTXSID1010005792-[(Bicyclo[3.1.0]hexan-3-yl)amino]benzoic acid
Database identifiers
- CAS
79531-64-9- PubChem CID
- 54381
- DTXSID
DTXSID101000579
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 282
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Compound notes
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