Clormecaine
Basic information
- CAS
13930-34-2- Standard SMILES
CN(C)CCOC(=O)c1ccc(Cl)c(N)c1- InChIKey
BMDZNGISRKXXIF-UHFFFAOYSA-N- Molecular formula
- C11H15ClN2O2
- Average molar mass
- 242.7 g/mol
- Monoisotopic mass
- 242.0822054
Overview
Clormecaine is a small molecule drug. The usage of the INN stem '-caine' in the name indicates that Clormecaine is a local anaesthetic. Clormecaine has a monoisotopic molecular weight of 242.08 Da.
Names & identifiers
- Preferred name
- Clormecaine
- IUPAC
- 2-(dimethylamino)ethyl 3-amino-4-chlorobenzoate
- English name
- clormecaine
- Molecular formula
- C11H15ClN2O2
- Molecular weight
- 242.7
Names & synonyms
Clormecaine13930-34-2ClormecainaClormecaine [INN]ClormecainumClormecainum [INN-Latin]UNII-RR5R8BAX26Clormecaina [INN-Spanish]RR5R8BAX26Rec 1/0060EINECS 237-699-9DTXSID40161003
Show more names
3-Amino-4-chlorobenzoic acid 2-(dimethylamino)ethyl ester
2-(Dimethylamino)ethyl 3-amino-4-chlorobenzoate esterClormecainum (INN-Latin)Clormecaina (INN-Spanish)RefChem:127101DTXCID2083494237-699-92-(dimethylamino)ethyl 3-amino-4-chlorobenzoateBenzoic acid, 3-amino-4-chloro-, 2-(dimethylamino)ethyl ester
Database identifiers
- CAS
13930-34-2- PubChem CID
- 56732
- DTXSID
DTXSID40161003- ChEMBL
CHEMBL2106019- UNII
- RR5R8BAX26
- EC Number
- 237-699-9
- Nikkaji
- J8.461A
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
Physicochemical properties
- FDA UNII
- 5 R8BAX26 · RR5R8BAX26
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Related reactions
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Compound notes
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