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> Main
CHEBI:27789 - 1,2-dichloroethane
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ChEBI Ontology
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ChEBI Name
1,2-dichloroethane
ChEBI ID
CHEBI:27789
Definition
A member of the class of chloroethanes substituted by two chloro groups at positions 1 and 2.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:49557, CHEBI:497, CHEBI:18881
Supplier Information
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Formula
C2H4Cl2
Net Charge
0
Average Mass
98.95856
Monoisotopic Mass
97.96901
InChI
InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2
InChIKey
WSLDOOZREJYCGB-UHFFFAOYSA-N
SMILES
ClCCCl
Roles Classification
Chemical Role
(s):
non-polar solvent
Biological Role
(s):
hepatotoxic agent
A role played by a chemical compound exihibiting itself through the ability to induce damage to the liver in animals.
mutagen
An agent that increases the frequency of mutations above the normal background level, usually by interacting directly with DNA and causing it damage, including base substitution.
Application
(s):
non-polar solvent
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1,2-dichloroethane (
CHEBI:27789
)
has role
hepatotoxic agent (
CHEBI:50908
)
1,2-dichloroethane (
CHEBI:27789
)
has role
mutagen (
CHEBI:25435
)
1,2-dichloroethane (
CHEBI:27789
)
has role
non-polar solvent (
CHEBI:48355
)
1,2-dichloroethane (
CHEBI:27789
)
is a
chloroethanes (
CHEBI:36016
)
IUPAC Name
1,2-dichloroethane
Synonyms
Sources
1,2-DCE
NIST Chemistry WebBook
1,2-Dichloräthan
ChEBI
1,2-Dichloroethane
KEGG COMPOUND
1,2-DICHLOROETHANE
PDBeChem
1,2-dichloroethane
UniProt
α,β-dichloroethane
NIST Chemistry WebBook
Äthylenchlorid
ChEBI
Äthylendichlorid
ChEBI
DCE
ChemIDplus
Dutch liquid
KEGG COMPOUND
EDC
ChemIDplus
ethane dichloride
ChemIDplus
ethylene chloride
ChemIDplus
Ethylene dichloride
KEGG COMPOUND
Glycol dichloride
KEGG COMPOUND
Manual Xrefs
Databases
1,2-Dichloroethane
Wikipedia
12-DICHLOROETHANE
MetaCyc
2774
PPDB
c0001
UM-BBD
C06752
KEGG COMPOUND
DB03733
DrugBank
DCE
PDBeChem
HMDB0029571
HMDB
View more database links
Registry Numbers
Types
Sources
107-06-2
CAS Registry Number
KEGG COMPOUND
107-06-2
CAS Registry Number
ChemIDplus
107-06-2
CAS Registry Number
NIST Chemistry WebBook
49272
Gmelin Registry Number
Gmelin
605264
Reaxys Registry Number
Reaxys
Citations
Types
Sources
17564600
PubMed citation
Europe PMC
18579268
PubMed citation
Europe PMC
24228488
PubMed citation
Europe PMC
24329990
PubMed citation
Europe PMC
24441515
PubMed citation
Europe PMC
31520740
PubMed citation
Europe PMC
32830330
PubMed citation
Europe PMC
33047531
PubMed citation
Europe PMC
Last Modified
17 June 2021