(Hydroxy-(3,4,5-trimethoxy-phenyl)-methyl]-phosphonic acid dimethyl ester

HCID 14101687

Basic information

Standard SMILES
COc1cc(C(O)P(=O)(OC)OC)cc(OC)c1OC
InChIKey
QLVDOJZFRXIUJX-UHFFFAOYSA-N
Molecular formula
C12H19O7P
Average molar mass
306.25 g/mol
Monoisotopic mass
306.08683994

Names & identifiers

Preferred name
(Hydroxy-(3,4,5-trimethoxy-phenyl)-methyl]-phosphonic acid dimethyl ester
IUPAC
dimethoxyphosphoryl-(3,4,5-trimethoxyphenyl)methanol

Names & synonyms

(Hydroxy-(3,4,5-trimethoxy-phenyl)-methyl]-phosphonic acid dimethyl ester[Hydroxy-(3,4,5-trimethoxy-phenyl)-methyl]-phosphonic acid dimethyl esterSCHEMBL1168375QLVDOJZFRXIUJX-UHFFFAOYSA-N

Database identifiers

PubChem CID
14101687

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
83.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
20

Related reactions

5 records

Linked notes

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