Ammonium, (3-hydroxy-p-tolyl)diethylmethyl-, iodide, methylcarbamate
Basic information
- CAS
64049-94-1- Standard SMILES
CC[N+](C)(CC)c1ccc(C)c(OC(=O)NC)c1.[I-]- InChIKey
YJMZJPJIMZUMEY-UHFFFAOYSA-N- Molecular formula
- C14H23IN2O2
- Average molar mass
- 378.25 g/mol
- Monoisotopic mass
- 378.08043
Names & identifiers
- Preferred name
- Ammonium, (3-hydroxy-p-tolyl)diethylmethyl-, iodide, methylcarbamate
- IUPAC
- diethyl-methyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]azanium iodide
Names & synonyms
TL-1257Carbamic acid, methyl-, (5-(diethylmethylammonio)-o-tolyl) ester, iodideT-1739Ammonium, (3-(methylcarbamoyloxy)-p-tolyl)diethylmethyl-, iodideCarbamic acid, methyl-, 2-methyl-5-diethylaminophenyl ester, methiodideAMMONIUM, (3-HYDROXY-p-TOLYL)DIETHYLMETHYL-, IODIDE, METHYLCARBAMATE64049-94-1RefChem:318865
Database identifiers
- CAS
64049-94-1- PubChem CID
- 46949
Properties
Computed structural properties
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 277
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Compound notes
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