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Home > Encyclopedia > Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI)

Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI)

Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI) structure

Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI) 

structure
  • CAS No:

    554432-72-3

  • Formula:

    C10H12O5

  • Chemical Name:

    Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI)

  • Synonyms:

    3-Hydroxypropyl 3,5-dihydroxybenzoate;CTK8J2575;ZINC39097313

Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI) Basic Attributes

212.19928

212.068

Characteristics

87

0.7

1.371±0.06 g/cm3(Predicted)

Computed Properties

Molecular Weight:212.20
XLogP3:0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:212.06847348
Monoisotopic Mass:212.06847348
Topological Polar Surface Area:87
Heavy Atom Count:15
Complexity:196
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of Benzoic acid, 3,5-dihydroxy-, 3-hydroxypropyl ester (9CI)

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