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

Butyl (2-chlorophenyl)carbamate

HCID 19166145
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
17425-16-0
Standard SMILES
CCCCOC(=O)Nc1ccccc1Cl
InChIKey
XISWHCXHSBZTJT-UHFFFAOYSA-N
Molecular formula
C11H14ClNO2
Average molar mass
227.69 g/mol
Monoisotopic mass
227.0713064

Names & identifiers

Preferred name
Butyl (2-chlorophenyl)carbamate
IUPAC
butyl N-(2-chlorophenyl)carbamate

Names & synonyms

17425-16-0Butyl (2-chlorophenyl)carbamateSCHEMBL21059156DTXSID80598177AKOS002963789

Database identifiers

CAS
17425-16-0
PubChem CID
19166145
DTXSID
DTXSID80598177

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
15
Formal charge
0
Complexity
199

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