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Home > Encyclopedia > 1,2,4-BENZENETRIMETHANOL

1,2,4-BENZENETRIMETHANOL

1,2,4-BENZENETRIMETHANOL structure

1,2,4-BENZENETRIMETHANOL 

structure
  • CAS No:

    25147-76-6

  • Formula:

    C9H12O3

  • Chemical Name:

    1,2,4-BENZENETRIMETHANOL

  • Synonyms:

    1,2,4-Benzenetrimethanol;[2,4-bis(hydroxymethyl)-phenyl]methanol;benzene-1,2,4-trimethanol;SCHEMBL63126;CTK0J9950;DTXSID30466817;ZINC2525137;(3,4-bis-hydroxymethylphenyl)methanol;AKOS006292907;[3,4-bis(hydroxymethyl)phenyl]methanol

1,2,4-BENZENETRIMETHANOL Basic Attributes

168.19

168.07900

DTXSID30466817

2906299090

Characteristics

60.7

0.16350

1.285±0.06 g/cm3(Predicted)

94-95 °C(Solv: chloroform (67-66-3))

Computed Properties

Molecular Weight:168.19
XLogP3:-0.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:168.078644241
Monoisotopic Mass:168.078644241
Topological Polar Surface Area:60.7
Heavy Atom Count:12
Complexity:127
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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