2,3-dihydroxypropyl hypochlorite

C3H7ClO3 — CID 54142459

IUPAC2,3-dihydroxypropyl hypochlorite
SMILESOCC(O)COCl
InChIInChI=1S/C3H7ClO3/c4-7-2-3(6)1-5/h3,5-6H,1-2H2
InChIKeyOCANCGNUSHKXGR-UHFFFAOYSA-N
MW126.54 g/mol
LogP-0.49
Rot. Bonds3

About 2,3-dihydroxypropyl hypochlorite

2,3-dihydroxypropyl hypochlorite (PubChem CID 54142459) has the molecular formula C3H7ClO3 and a molecular weight of 126.54 g/mol. Its IUPAC name is 2,3-dihydroxypropyl hypochlorite.

Molecular Properties

Compound Name2,3-dihydroxypropyl hypochlorite
PubChem CID54142459
Molecular FormulaC3H7ClO3
Molecular Weight126.54 g/mol
Exact Mass126.01
IUPAC Name2,3-dihydroxypropyl hypochlorite
SMILESOCC(O)COCl
InChIInChI=1S/C3H7ClO3/c4-7-2-3(6)1-5/h3,5-6H,1-2H2
InChIKeyOCANCGNUSHKXGR-UHFFFAOYSA-N
XLogP-0.49
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.54
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

CID 88654281
CID 88654281
(3-amino-2-hydroxypropyl) hypochlorite
CID 129235335
3-(2,3-dihydroxypropoxy)propane-1,2-diol;propane-1,2,3-triol
CID 87090459
[(2R)-2-hydroxy-3-methoxypropyl] hypochlorite
CID 129235320
3-(2,3-dihydroxypropoxymethoxy)propane-1,2-diol
CID 59854090
magnesium;3-(2,3-dihydroxypropoxy)propane-1,2-diol;dichloride
CID 174372262
2,3-dihydroxypropyl hypobromite
CID 23618335
acetic acid;3-(2,3-dihydroxypropoxy)propane-1,2-diol
CID 161329261
3-alumanyloxypropane-1,2-diol;hydrate
CID 175040136
3-methoxypropane-1,2-diol;dihydrochloride
CID 87908148
acetic acid;3-methoxypropane-1,2-diol
CID 71422269
chloro 2,3-dihydroxypropyl phosphate
CID 22670557

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxypropyl hypochlorite?
The IUPAC name of 2,3-dihydroxypropyl hypochlorite (CID 54142459) is 2,3-dihydroxypropyl hypochlorite.
What is the SMILES notation for 2,3-dihydroxypropyl hypochlorite?
The canonical SMILES for 2,3-dihydroxypropyl hypochlorite is OCC(O)COCl.
What is the InChIKey of 2,3-dihydroxypropyl hypochlorite?
The InChIKey is OCANCGNUSHKXGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7ClO3/c4-7-2-3(6)1-5/h3,5-6H,1-2H2.
What are the key properties of 2,3-dihydroxypropyl hypochlorite?
2,3-dihydroxypropyl hypochlorite has a molecular weight of 126.54 g/mol, XLogP of -0.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxypropyl hypochlorite is sourced from PubChem (CID 54142459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).