Basic information
- CAS
64046-32-8- Standard SMILES
CNC(=O)Oc1ccc(C)c([N+](C)(C)Cc2ccccc2)c1.[Br-]- InChIKey
JRUJWBZXKCBXGL-UHFFFAOYSA-N- Molecular formula
- C18H23BrN2O2
- Average molar mass
- 379.3 g/mol
- Monoisotopic mass
- 378.09429
Names & identifiers
- Preferred name
- Ammonium, ((5-hydroxy-2-methyl)phenyl)benzyldimethyl-, bromide, methylcarbamate
- IUPAC
- benzyl-dimethyl-[2-methyl-5-(methylcarbamoyloxy)phenyl]azanium bromide
Names & synonyms
TL-1338Carbamic acid, methyl-, 3-(benzyldimethylammonio)-p-tolyl ester, bromideAmmonium, ((2-methyl-5-methylcarbamoyloxy)phenyl)benzyldimethyl-, bromideAMMONIUM, ((5-HYDROXY-2-METHYL)PHENYL)BENZYLDIMETHYL-, BROMIDE, METHYLCARBAMATECarbamic acid, N-methyl-, 4-methyl-3-(methylbenzylamino)phenyl ester, methobromide64046-32-8RefChem:318659
Database identifiers
- CAS
64046-32-8- PubChem CID
- 46609
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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