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Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)

HCID 94445
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Basic information

CAS
33125-86-9
Standard SMILES
O=P(OCCCl)(OCCCl)OCCOP(=O)(OCCCl)OCCCl
InChIKey
CJWBPEYRTPGWPF-UHFFFAOYSA-N
Molecular formula
C10H20Cl4O8P2
Average molar mass
472 g/mol
Monoisotopic mass
469.938752

Names & identifiers

Preferred name
Tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)
IUPAC
2-[bis(2-chloroethoxy)phosphoryloxy]ethyl bis(2-chloroethyl) phosphate
English name
ethylene bis(bis(2-chloroethyl)phosphate)
Molecular formula
C10H20Cl4O8P2
Molecular weight
472.020522

Names & synonyms

33125-86-9tetrakis(2-chloroethyl) ethane-1,2-diyl bis(phosphate)Phosphoric acid, 1,2-ethanediyl tetrakis(2-chloroethyl) ester5I441BG8E9Phosphoric acid, ethylene tetrakis(2-chloroethyl) esterTHERMOLIN 101DTXSID5027980tetrakis(2-chloroethyl) ethylene diphosphatePhosphoric acid, P,P'-1,2-ethanediyl P,P,P',P'-tetrakis(2-chloroethyl) esterETHANOL, 2-CHLORO-, ETHYLENE PHOSPHATE (4:1)RefChem:897229DTXCID907980
Show more names
TETRAKIS(2-CHLOROETHYL)-ETHYLENEDIPHOSPHATE(Ethylenebisoxy)bis[phosphonic acid bis(2-chloroethyl)] ester
Ethylene bis(bis(2-chloroethyl)phosphate)Tetrakis(2-chloroethyl)ethylene diphosphateEINECS 251-384-3UNII-5I441BG8E9Ethylenebis(bis(2-chloroethyl)phosphate)Phosphoric acid, 1,2-ethanediyl tetrakis(2-chloroethyl)esterSCHEMBL4996011,2-Bis[bis(2-chloroethyl)phosphato]ethane

Database identifiers

CAS
33125-86-9
PubChem CID
94445
DTXSID
DTXSID5027980
UNII
5I441BG8E9
EC Number
251-384-3
Nikkaji
J278.888H

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
89.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
17
Heavy atoms
24
Formal charge
0
Complexity
343

Physicochemical properties

EWG's Food Scores
1 · 1
FDA UNII
5 I441BG8E9 · 5I441BG8E9
EPA Substance Registry System
Tetrakis(2-chloroethyl)ethylene diphosphate (33125-86-9)
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 InformationChemical: Phosphoric acid, 1,2-ethanediyl tetrakis(2-chloroethyl) ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPhosphoric acid, P,P'-1,2-ethanediyl P,P,P',P'-tetrakis(2-chloroethyl) ester: INACTIVE

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Compound notes

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