CHEBI:18917 - 1,3-dichloropropan-2-ol

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ChEBI Name 1,3-dichloropropan-2-ol
ChEBI ID CHEBI:18917
Definition A secondary alcohol that is isopropanol in which one hydrogen of each methyl group is substituted by a chlorine. A liquid at room temperature (melting point −4°C, boiling point 174°C at 760 mm Hg), it is used as a solvent for hard resins and nitrocellulose.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:34059
Supplier Information
Download Molfile XML SDF
Formula C3H6Cl2O
Net Charge 0
Average Mass 128.98500
Monoisotopic Mass 127.97957
InChI InChI=1S/C3H6Cl2O/c4-1-3(6)2-5/h3,6H,1-2H2
InChIKey DEWLEGDTCGBNGU-UHFFFAOYSA-N
SMILES OC(CCl)CCl
Roles Classification
Chemical Role(s): protic solvent
A polar solvent that is capable of acting as a hydron (proton) donor.
Application(s): protic solvent
A polar solvent that is capable of acting as a hydron (proton) donor.
cross-linking reagent
A reagent with two reactive groups, usually at opposite ends of the molecule, that are capable of reacting with and thereby forming bridges between macromolecules, principally side chains of amino acids in proteins, allowing the locations of naturally reactive areas within the proteins to be identified.
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ChEBI Ontology
Outgoing 1,3-dichloropropan-2-ol (CHEBI:18917) has role cross-linking reagent (CHEBI:50684)
1,3-dichloropropan-2-ol (CHEBI:18917) has role protic solvent (CHEBI:48356)
1,3-dichloropropan-2-ol (CHEBI:18917) is a organochlorine compound (CHEBI:36683)
1,3-dichloropropan-2-ol (CHEBI:18917) is a secondary alcohol (CHEBI:35681)
IUPAC Name
1,3-dichloropropan-2-ol
Synonyms Sources
1,3-DCP ChEBI
1,3-dichloro-1,3-dideoxyglycerol ChEBI
1,3-dichloro-2-hydroxypropane ChemIDplus
1,3-Dichloro-2-propanol KEGG COMPOUND
1,3-dichlorohydrin ChemIDplus
1,3-dichloroisopropanol ChemIDplus
1,3-dichloroisopropyl alcohol ChemIDplus
1,3-dichloropropan-2-ol NIST Chemistry WebBook
2-chloro-1-(chloromethyl)ethanol NIST Chemistry WebBook
α,γ-dichlorohydrin NIST Chemistry WebBook
α-dichlorohydrin NIST Chemistry WebBook
glycerol 1,3-dichlorohydrin ChemIDplus
HOCH(CH2Cl)2 ChEBI
sym-dichloroisopropyl alcohol ChemIDplus
sym-glycerol dichlorohydrin NIST Chemistry WebBook
Manual Xrefs Databases
c0018 UM-BBD
C14399 KEGG COMPOUND
RU2263656 Patent
View more database links
Registry Numbers Types Sources
1732063 Reaxys Registry Number Reaxys
96-23-1 CAS Registry Number KEGG COMPOUND
96-23-1 CAS Registry Number ChemIDplus
96-23-1 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
12110283 PubMed citation Europe PMC
17524555 PubMed citation Europe PMC
19047007 PubMed citation Europe PMC
19731046 PubMed citation Europe PMC
20113855 PubMed citation Europe PMC
Last Modified
14 November 2013