HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

ethyl N-(3-acetylphenyl)carbamate

HCID 717681
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)Nc1cccc(C(C)=O)c1
InChIKey
MTRQKDPBIMRAFG-UHFFFAOYSA-N
Molecular formula
C11H13NO3
Average molar mass
207.23 g/mol
Monoisotopic mass
207.08954328

Names & identifiers

Preferred name
ethyl N-(3-acetylphenyl)carbamate
IUPAC
ethyl N-(3-acetylphenyl)carbamate

Names & synonyms

(3-acetylphenyl)carbamic acid, ethyl esterethyl N-(3-acetylphenyl)carbamateethyl 3-acetylphenylcarbamateSCHEMBL10747742MTRQKDPBIMRAFG-UHFFFAOYSA-NN-(3-acetylphenyl)ethoxycarboxamideethyl N-(3-acetyl-phenyl)-carbamateAKOS000168096SDCCGSBI-0661448.P001ST094629AE-641/12753017

Database identifiers

PubChem CID
717681

Properties

Computed structural properties

XLogP
2
Topological polar surface area
55.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
240

Related reactions

3 records
New reaction record
HRID 236640 reaction equation
HRID 236640As reactantuspto-grants-1987_02
HRID 464695 reaction equation
HRID 464695As reactantuspto-grants-1985_10
HRID 1906846 reaction equation
HRID 1906846As productuspto-grants-1987_03

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes