Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate
Basic information
- CAS
6452-64-8- Standard SMILES
CNC(=O)Oc1cc(C)c(CN(C)C)c(C)c1- InChIKey
PBJQYLSKNASHPU-UHFFFAOYSA-N- Molecular formula
- C13H20N2O2
- Average molar mass
- 236.31 g/mol
- Monoisotopic mass
- 236.15247789
Names & identifiers
- Preferred name
- Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamate
- IUPAC
- [4-[(dimethylamino)methyl]-3,5-dimethylphenyl] N-methylcarbamate
- English name
- Methylcarbamic acid 4-[(dimethylamino)methyl]-3,5-dimethylphenyl ester
- Molecular formula
- C13H20N2O2
- Molecular weight
- 236.31
Names & synonyms
Thompson-hayward T-H 255-IC2OUP9DPC8BRN 2740844CARBAMIC ACID, METHYL-, 4-((DIMETHYLAMINO)METHYL)-3,5-DIMETHYLPHENYL ESTERUNII-C2OUP9DPC8NSC-190928DTXSID80214789Methyl 4-((dimethylamino)methyl)-3,5-dimethylphenylcarbamateCarbamic acid, methyl-, 4-[(dimethylamino)methyl]-3,5-dimethylphenyl ester4-Dimethylaminomethyl-3,5-xylyl N-methylcarbamateRefChem:201702DTXCID60137280
Show more names
We-417TH-255-IENT-27328-XThompson-Hayward T-H-255-IPhenol, 4-[(dimethylamino)methyl]-3,5-dimethyl-, 1-(N-methylcarbamate)Methylcarbamic acid 4-[(dimethylamino)methyl]-3,5-dimethylphenyl ester
PBJQYLSKNASHPU-UHFFFAOYSA-NWE 4176452-64-8TH 255-IENT 27,328-XNSC 190928Phenol, 4-((dimethylamino)methyl)-3,5-dimethyl-, methylcarbamate (ester)Phenol, 4-[(dimethylamino)methyl]-3,5-dimethyl-, methylcarbamate (ester)
Database identifiers
- CAS
6452-64-8- PubChem CID
- 22956
- DTXSID
DTXSID80214789- UNII
- C2OUP9DPC8
- Nikkaji
- J13.371J
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- FDA UNII
- 2 OUP9DPC8 · C2OUP9DPC8
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Compound notes
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