Basic information
- CAS
64049-96-3- Standard SMILES
CCOC(=O)C[N+](C)(C)c1ccc(C)c(OC(=O)NC)c1.[Cl-]- InChIKey
YFCUVTOQZWNLTR-UHFFFAOYSA-N- Molecular formula
- C15H23ClN2O4
- Average molar mass
- 330.81 g/mol
- Monoisotopic mass
- 330.1346349
Names & identifiers
- Preferred name
- Ammonium, (3-hydroxy-p-tolyl)dimethyl(ethoxycarbonylmethyl)-, chloride, methylcarbamate
- IUPAC
- (2-ethoxy-2-oxoethyl)-dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium chloride
Names & synonyms
TL-1513Ammonium, (3-(methylcarbamoyloxy)-p-tolyl)dimethyl(ethoxycarbonylmethyl)-, chlorideAmmonium, (3-hydroxy-p-tolyl)dimethyl(ethoxycarbonylmethyl)-, chloride, methylcarbamateCarbamic acid, N-methyl-, 2-methyl-5-dimethylaminophenyl ester, carbethoxymethochloride64049-96-3RefChem:318867
Database identifiers
- CAS
64049-96-3- PubChem CID
- 46953
Properties
Computed structural properties
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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