ECTO | Classes | AgroPortal

ID	http://purl.obolibrary.org/obo/CHEBI_142471 http://purl.obolibrary.org/obo/CHEBI_142471 https://agroportal.lirmm.fr/ontologies/ECTO/CHEBI_142471 Loading
Preferred name	(S)-1,2-dichloropropane
Synonyms	(2S)-alpha,beta-propylene dichloride (2S)-1,2-dichloropropane (2S)-propylene dichloride (2S)-1,2-DCP (2S)-alpha,beta-dichloropropane
Definitions	A 1,2-dichloropropane that has S configuration.

oboinowl_gen:inSubset	http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles	C[C@@H](CCl)Cl
obo_purl:charge	0
obo_purl:inchikey	KNKRKFALVUDBJE-VKHMYHEASA-N
oboinowl_gen:hasDbXref	Reaxys:1718881 PMID:28527381
obo_purl:IAO_0000115	A 1,2-dichloropropane that has S configuration.
skos:notation	CHEBI:142471
oboinowl_gen:hasExactSynonym	(2S)-1,2-dichloropropane
obo_purl:mass	112.986
obo_purl:inchi	InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3/t3-/m0/s1
obo_purl:formula	C3H6Cl2
oboinowl_gen:hasOBONamespace	chebi_ontology
rdf:type	http://www.w3.org/2002/07/owl#Class
obo_purl:is_enantiomer_of	http://purl.obolibrary.org/obo/CHEBI_142469
oboinowl_gen:hasRelatedSynonym	(2S)-alpha,beta-propylene dichloride (2S)-propylene dichloride (2S)-1,2-DCP (2S)-alpha,beta-dichloropropane
oboinowl_gen:id	CHEBI:142471
rdfs:label	(S)-1,2-dichloropropane
obo_purl:monoisotopicmass	111.98466
rdfs:subClassOf	http://purl.obolibrary.org/obo/CHEBI_142468

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