Basic information
- CAS
20131-75-3- Standard SMILES
Cc1ccccc1NC(=O)OC1CCCCC1[NH+]1CCCC1.[Cl-]- InChIKey
QGTBXMXACGMFFG-UHFFFAOYSA-N- Molecular formula
- C18H27ClN2O2
- Average molar mass
- 338.9 g/mol
- Monoisotopic mass
- 338.1761058
Names & identifiers
- Preferred name
- 2-(Pyrrolidin-1-yl)cyclohexyl hydrogen (2-methylphenyl)carbonimidate--hydrogen chloride (1/1)
- IUPAC
- (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(2-methylphenyl)carbamate chloride
Names & synonyms
20131-75-3DTXSID709421602-(Pyrrolidin-1-yl)cyclohexyl hydrogen (2-methylphenyl)carbonimidate--hydrogen chloride (1/1)RefChem:1062050DTXCID301370574o-Methylcarbanilic acid 2-(1-pyrrolidinyl)cyclohexyl ester hydrochlorideK 1402CARBANILIC ACID, o-METHYL-, 2-(1-PYRROLIDINYL)CYCLOHEXYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
20131-75-3- PubChem CID
- 29967
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 368
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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