Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:82166 - Chloromebuform
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
Chloromebuform
ChEBI ID
CHEBI:82166
Stars
This entity has been manually annotated by a third party.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C13H19ClN2
Net Charge
0
Average Mass
238.75600
Monoisotopic Mass
238.12368
InChI
InChI=1S/C13H19ClN2/c1-4-5-8-16(3)10-15-13-7-6-12(14)9-11(13)2/h6-7,9-10H,4-5,8H2,1-3H3/b15-10+
InChIKey
OUDYXRYNDPEKLK-XNTDXEJSSA-N
SMILES
CCCCN(C)\C=N\c1ccc(Cl)cc1C
ChEBI Ontology
Outgoing
Chloromebuform (
CHEBI:82166
)
is a
monochlorobenzenes (
CHEBI:83403
)
Manual Xref
Database
C19037
KEGG COMPOUND
View more database links
Registry Number
Type
Source
37407-77-5
CAS Registry Number
KEGG COMPOUND
Last Modified
24 October 2014