Benzylhydroxymethylphosphinic acid, n-butyl ester

HCID 86752201
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Basic information

Standard SMILES
CCCCOP(=O)(CO)Cc1ccccc1
InChIKey
IGXQPKQEVHLOAZ-UHFFFAOYSA-N
Molecular formula
C12H19O3P
Average molar mass
242.25 g/mol

Names & identifiers

Preferred name
Benzylhydroxymethylphosphinic acid, n-butyl ester
IUPAC
[benzyl(butoxy)phosphoryl]methanol

Names & synonyms

IGXQPKQEVHLOAZ-UHFFFAOYSA-NBenzylhydroxymethylphosphinic acid, n-butyl ester

Database identifiers

PubChem CID
86752201

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
16

Related reactions

2 records
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Linked notes

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