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Phosphonic acid, (2-(acetyloxy)ethyl)-, dipropyl ester

HCID 217648
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Basic information

CAS
39118-54-2
Standard SMILES
CCCOP(=O)(CCOC(C)=O)OCCC
InChIKey
DQBJKAPMTBEDGG-UHFFFAOYSA-N
Molecular formula
C10H21O5P
Average molar mass
252.24 g/mol
Monoisotopic mass
252.11266076

Names & identifiers

Preferred name
Phosphonic acid, (2-(acetyloxy)ethyl)-, dipropyl ester
IUPAC
2-dipropoxyphosphorylethyl acetate

Names & synonyms

2-Dipropylphosphonoethyl acetate39118-54-2BRN 1964215(2-(Acetyloxy)ethyl)phosphonic acid dipropyl esterPhosphonic acid, (2-(acetyloxy)ethyl)-, dipropyl esterDTXSID20192370RefChem:370428DTXCID301148612-(dipropoxyphosphoryl)ethyl acetate

Database identifiers

CAS
39118-54-2
PubChem CID
217648
DTXSID
DTXSID20192370

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
61.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
16
Formal charge
0
Complexity
229

Related reactions

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Compound notes

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