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2,2,2-trichloroethanol

PropertiesImage
MNX_IDMNXM3152 Image of MNXM3152
referencechebi:28094
formulaC2H3Cl3O
global charge0
mol weight149.404
InChIKeyKPWDGTGXUYRARH-UHFFFAOYSA-N
InChIInChI=1S/C2H3Cl3O/c3-2(4,5)1-6/h6H,1H2
SMILESOCC(Cl)(Cl)Cl
MNX internals
InChI (mnx)InChI=1/C2H3Cl3O/c3-2(4,5)1-6/h6H,1H2 Image of MNXM3152
SMILES (mnx)[CH2:1]([C:2]([Cl:3])([Cl:4])[Cl:5])[OH:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)10
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28094
chebi:28094
KPWDGTGXUYRARH-UHFFFAOYSA-N 		2,2,2-trichloroethanol
2,2,2-Trichloroethanol
2,2,2-trichloro-1-ethanol
Trichloroethanol
hmdb:HMDB0041796
KPWDGTGXUYRARH-UHFFFAOYSA-N 		2,2,2-Trichloroethanol
(Hydroxymethyl)trichloromethane
2, 2,2-Trichloroethanol
2,2,2-Trichloro-1-ethanol
2,2,2-Trichloro-ethanol
2,2,2-Trichloroethanol (acd/name 4.0)
2,2,2-Trichloroethyl alcohol
2,2,2-trichloroethan-1-ol
CCL3ch2oh
Trichlorethanol
Trichloroethanol
Trichloroethyl alcohol
beta,beta,.beta-trichloroethanol
beta-Trichloroethanol
trichloroethanol

envipath:...e3773582fad5
envipathM:...e3773582fad5
KPWDGTGXUYRARH-UHFFFAOYSA-N 		Trichloroethanol

kegg.compound:C07490
keggC:C07490
KPWDGTGXUYRARH-UHFFFAOYSA-N 		Trichloroethanol
2,2,2-Trichloroethanol

seed.compound:cpd04661
seedM:cpd04661
KPWDGTGXUYRARH-UHFFFAOYSA-N 		Trichloroethanol
2,2,2-Trichloroethanol
trichloroethanol

vmhM:M03043
vmhmetabolite:M03043
KPWDGTGXUYRARH-UHFFFAOYSA-N 		Trichloroethanol
2,2,2-trichloroethan-1-ol

envipath:...bed784299bc1
envipathM:...bed784299bc1
KPWDGTGXUYRARH-UHFFFAOYSA-N 		compound 0044507

metacyc.compound:CPD-9673
metacycM:CPD-9673
KPWDGTGXUYRARH-UHFFFAOYSA-N 		trichloroethanol

hmdb:HMDB41796
chebi:27098
chebi:9685
keggC:M_C07490
seedM:M_cpd04661
vmhM:M_M03043 		secondary/obsolete/fantasy identifier