HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

1-chlorobut-3-en-2-yl N-(3-chlorophenyl)carbamate

HCID 238974
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
6328-27-4
Standard SMILES
C=CC(CCl)OC(=O)Nc1cccc(Cl)c1
InChIKey
QGCTXZQTQKRWJW-UHFFFAOYSA-N
Molecular formula
C11H11Cl2NO2
Average molar mass
260.11 g/mol
Monoisotopic mass
259.016684

Names & identifiers

Preferred name
1-chlorobut-3-en-2-yl N-(3-chlorophenyl)carbamate
IUPAC
1-chlorobut-3-en-2-yl N-(3-chlorophenyl)carbamate

Names & synonyms

NSC436546328-27-4NSC-43654

Database identifiers

CAS
6328-27-4
PubChem CID
238974

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
248

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes