Cas no 110706-49-5 ((4-Chloro-1,2-phenylene)dimethanol)

(4-Chloro-1,2-phenylene)dimethanol structure
110706-49-5 structure
Product Name:(4-Chloro-1,2-phenylene)dimethanol
CAS No:110706-49-5
MF:C8H9ClO2
MW:172.608861684799
MDL:MFCD15147234
CID:1194906
PubChem ID:10899147
Update Time:2024-11-03

(4-Chloro-1,2-phenylene)dimethanol Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzenedimethanol, 4-chloro-
    • (4-Chloro-1,2-phenylene)dimethanol
    • [4-chloro-2-(hydroxymethyl)phenyl]methanol
    • 4-chloro-1,2-Benzenedimethanol
    • (4-Chloro-2-hydroxymethyl-phenyl)-methanol
    • 4-Chlorobenzene-1,2-bismethanol
    • SB30664
    • DTXSID00447597
    • ARSFSTVKMONOTE-UHFFFAOYSA-N
    • AM806231
    • AS-61877
    • SCHEMBL1154758
    • FT-0714434
    • CS-0039140
    • 4-Chloro-1,2-bis(hydroxymethyl)benzene
    • 110706-49-5
    • MFCD15147234
    • 4-chloro-o-xylylene glycol
    • DA-39761
    • AKOS024260825
    • MDL: MFCD15147234
    • Inchi: 1S/C8H9ClO2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3,10-11H,4-5H2
    • InChI Key: ARSFSTVKMONOTE-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(CO)=C(C=1)CO

Computed Properties

  • Exact Mass: 172.0291072 g/mol
  • Monoisotopic Mass: 172.0291072 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 119
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Molecular Weight: 172.61
  • XLogP3: 0.8
  • Topological Polar Surface Area: 40.5?2

Experimental Properties

  • Density: 1.337±0.06 g/cm3(Predicted)
  • Melting Point: 85 °C
  • Boiling Point: 320.6±32.0 °C(Predicted)
  • PSA: 40.46000
  • LogP: 1.32460

(4-Chloro-1,2-phenylene)dimethanol Pricemore >>

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abcr
AB455247-250 mg
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