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1,2-Propanediol, 3-chloro-, phosphate

HCID 92517
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
56729-01-2
Standard SMILES
O=P(O)(O)O.OCC(O)CCl
InChIKey
GUGYAJQIQPZZBD-UHFFFAOYSA-N
Molecular formula
C3H10ClO6P
Average molar mass
208.53 g/mol
Monoisotopic mass
207.9903527

Names & identifiers

Preferred name
1,2-Propanediol, 3-chloro-, phosphate
IUPAC
3-chloropropane-1,2-diol;phosphoric acid
English name
1,2-Propanediol, 3-chloro-, phosphate
Molecular formula
C3H10ClO6P
Molecular weight
0

Names & synonyms

1,2-Propanediol, 3-chloro-, phosphateDTXSID401014969RefChem:72133DTXCID20147330556729-01-2GUGYAJQIQPZZBD-UHFFFAOYSA-N3-Chloro-1,2-propanediol phosphateDB-228572Phosphoric acid--3-chloropropane-1,2-diol (1/1)

Database identifiers

CAS
56729-01-2
PubChem CID
92517
DTXSID
DTXSID401014969

Properties

Computed structural properties

Topological polar surface area
118 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
81.8

Experimental & physicochemical properties

Physical DescriptionLiquid

Physicochemical properties

EPA Substance Registry System
1 · 1,2-Propanediol, 3-chloro-, phosphate (56729-01-2)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory Information · 2 items

1,2-Propanediol, 3-chloro-, phosphate is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2-Propanediol, 3-chloro-, phosphate are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

U.S. Production2023: 20,976 lb
Industry UsesIntermediate
General Manufacturing Information · 2 items

Soap, Cleaning Compound, and Toilet Preparation Manufacturing

1,2-Propanediol, 3-chloro-, phosphate: ACTIVE

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes