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Phenol, 3-(1-(dimethylamino)ethyl)-, 1-(N-methylcarbamate)

HCID 46093
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
4464-16-8
Standard SMILES
CNC(=O)Oc1cccc(C(C)N(C)C)c1
InChIKey
KQOUPMYYRQWZLI-UHFFFAOYSA-N
Molecular formula
C12H18N2O2
Average molar mass
222.28 g/mol
Monoisotopic mass
222.13682782

Overview

Miotine is a member of benzenes.

Names & identifiers

Preferred name
Phenol, 3-(1-(dimethylamino)ethyl)-, 1-(N-methylcarbamate)
IUPAC
[3-[1-(dimethylamino)ethyl]phenyl] N-methylcarbamate
English name
Methylcarbamic acid [3-[1-(dimethylamino)ethyl]phenyl] ester
Molecular weight
0

Names & synonyms

MiotineMiotin4464-16-89Z3ZT09RRU3-(1-(Dimethylamino)ethyl)phenyl methylcarbamate[3-[1-(dimethylamino)ethyl]phenyl] N-methylcarbamatePhenol, 3-(1-(dimethylamino)ethyl)-, 1-(N-methylcarbamate)Phenol, 3-(1-(dimethylamino)ethyl)-, methylcarbamate (ester)Carbamic acid, methyl-, m-(1-(dimethylamino)ethyl)phenyl esterDTXSID102754893-[1-(dimethylamino)ethyl]phenyl methylcarbamate(3-(1-(dimethylamino)ethyl)phenyl) N-methylcarbamate
Show more names
RefChem:1094876DTXCID60226926Deethyl rivastigmine, (+/-)-UNII-9Z3ZT09RRUMethylcarbamic acid [3-[1-(dimethylamino)ethyl]phenyl] esterC11763AC1L2FBXAC1Q60SR

Database identifiers

CAS
4464-16-8
PubChem CID
46093
DTXSID
DTXSID10275489
ChEMBL
CHEMBL1181675

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
41.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
231

Physicochemical properties

FDA UNII
9 Z3ZT09RRU · 9Z3ZT09RRU

Chemistry & industry

Additional notes

DefinitionChEBI: Miotine is a member of benzenes.

Related reactions

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
ChEBI
CHEBI:6943
UNII
9Z3ZT09RRU
Nikkaji
J391.662F