Basic information
- CAS
31755-24-5- Standard SMILES
Cc1cccc(Cl)c1NC(=O)OC1CCC[NH+](C(C)(C)C)C1.[Cl-]- InChIKey
CZGLGDWLDZFFRP-UHFFFAOYSA-N- Molecular formula
- C17H26Cl2N2O2
- Average molar mass
- 361.3 g/mol
- Monoisotopic mass
- 360.1371335
Names & identifiers
- Preferred name
- Carbanilic acid, 6-chloro-2-methyl-, N-tert-butyl-3-piperidinyl ester, hydrochloride
- IUPAC
- (1-tert-butylpiperidin-1-ium-3-yl) N-(2-chloro-6-methylphenyl)carbamate chloride
Names & synonyms
31755-24-5Carbanilic acid, 6-chloro-2-methyl-, N-tert-butyl-3-piperidinyl ester, hydrochlorideRefChem:1081086N-tert-Butyl-3-piperidyl 2-chloro-6-methylphenylcarbamate hydrochlorideN-tert-Butyl-3-piperidinyl 6-chloro-2-methylcarbanilate hydrochloride6-Chloro-2-methylcarbanilic acid hydrochloride, N-tert-butyl-3-piperidinyl esterCarbamic acid, (2-chloro-6-methylphenyl)-, 1-(1,1-dimethylethyl)-3-piperidinyl ester, HCl
Database identifiers
- CAS
31755-24-5- PubChem CID
- 35907
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
- 383
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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