1,3-dichloropropane (CHEBI:137978)

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ChEBI Name	1,3-dichloropropane

ChEBI ID	CHEBI:137978

Definition	A chloroalkane that is propane in which a hydrogen from each of the terminal methyl groups has been replaced by a chlorine.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C3H6Cl2

Net Charge

Average Mass

112.986

Monoisotopic Mass

111.98466

InChI

InChI=1S/C3H6Cl2/c4-2-1-3-5/h1-3H2

InChIKey

YHRUOJUYPBUZOS-UHFFFAOYSA-N

SMILES

ClCCCCl

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Application(s):	nematicide A substance used to destroy pests of the phylum Nematoda (roundworms).

ChEBI Ontology
Outgoing	1,3-dichloropropane (CHEBI:137978) has role environmental contaminant (CHEBI:78298) 1,3-dichloropropane (CHEBI:137978) has role nematicide (CHEBI:25491) 1,3-dichloropropane (CHEBI:137978) is a chloroalkane (CHEBI:23128) 1,3-dichloropropane (CHEBI:137978) is a chlorohydrocarbon (CHEBI:23115)

IUPAC Name

1,3-dichloropropane

Last Modified

20 May 2021