Basic information
- CAS
29440-71-9- Standard SMILES
Cc1ccccc1NC(=O)OC1CN2CCC1CC2- InChIKey
JZGDWROMWFPLTM-UHFFFAOYSA-N- Molecular formula
- C15H20N2O2
- Average molar mass
- 260.33 g/mol
- Monoisotopic mass
- 260.15247789
Names & identifiers
- Preferred name
- Carbanilic acid, o-methyl-, 3-quinuclidinyl ester
- IUPAC
- 1-azabicyclo[2.2.2]octan-3-yl N-(2-methylphenyl)carbamate
Names & synonyms
o-Methylcarbanilic acid 3-quinuclidinyl esterBRN 1474567CARBANILIC ACID, o-METHYL-, 3-QUINUCLIDINYL ESTER29440-71-9RefChem:333135Maybridge2_000464SCHEMBL12604472DTXSID80951960HMS1304F021-Azabicyclo[2.2.2]octan-3-yl hydrogen (2-methylphenyl)carbonimidate
Database identifiers
- CAS
29440-71-9- PubChem CID
- 34584
- DTXSID
DTXSID80951960
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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