Cas no 4712-88-3 (1-Butanone,1-(5-hydroxy-1-naphthalenyl)-)

1-Butanone,1-(5-hydroxy-1-naphthalenyl)- structure
4712-88-3 structure
Product Name:1-Butanone,1-(5-hydroxy-1-naphthalenyl)-
CAS No:4712-88-3
MF:C8H7ClO2
MW:170.59298157692
CID:334861
PubChem ID:74061
Update Time:2025-04-19

1-Butanone,1-(5-hydroxy-1-naphthalenyl)- Chemical and Physical Properties

Names and Identifiers

    • 1-Butanone,1-(5-hydroxy-1-naphthalenyl)-
    • 1'-Butyronaphthone,5'-hydroxy- (7CI,8CI)
    • 1-(5-chloro-2-hydroxyphenyl)-ethanone
    • FT-0620251
    • 5'-Chloro-2'-Hydroxy acetophenone
    • 1-(5-Chloro-2-hydroxyphenyl)ethanone #
    • 5'-Chloro-2'-hydroxyacetophenone
    • W-108143
    • CHEMBL4556310
    • Acetophenone, 5-chloro-2-hydroxy-
    • NSC-46622
    • 1-(5-Chloro-2-hydroxyphenyl)ethan-1-one
    • UY5U246MAZ
    • UNII-UY5U246MAZ
    • AKOS000121001
    • AC-8265
    • SY061655
    • A808312
    • 5'-Chloro-2'-hydroxyacetophenone, 99%
    • 6C-033
    • NS00024718
    • MFCD00067788
    • 1-(5-CHLORO-2-HYDROXYPHENYL)-1-ETHANONE
    • Z57101024
    • 5'-chloro-2'- hydroxyacetophenone
    • 2'-Hydroxy-5'-chloroacetophenone
    • 3-Chloro-6-hydroxyacetophenone
    • EINECS 215-916-8
    • NSC 46622
    • 1-(5-chloranyl-2-oxidanyl-phenyl)ethanone
    • InChI=1/C8H7ClO2/c1-5(10)7-4-6(9)2-3-8(7)11/h2-4,11H,1H
    • 1-(5-chloro-2-hydroxy-phenyl)-ethanone
    • SCHEMBL218964
    • EN300-17921
    • ETHANONE, 1-(5-CHLORO-2-HYDROXYPHENYL)-
    • 1-(5-Chloro-2-hydroxyphenyl)ethanone
    • A7447
    • 4712-88-3
    • 2-hydroxy-5-chloroacetophenone
    • 1450-74-4
    • 5 inverted exclamation mark -Chloro-2 inverted exclamation mark -hydroxyacetophenone
    • DTXSID90162863
    • NSC46622
    • CS-W004713
    • 2-Acetyl-4-chlorophenol
    • 5-Chloro-2-hydroxyacetophenone
    • Acetophenone, 5'-chloro-2'-hydroxy-
    • Inchi: 1S/C8H7ClO2/c1-5(10)7-4-6(9)2-3-8(7)11/h2-4,11H,1H3
    • InChI Key: XTGCUDZCCIRWHL-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=C(C(C)=O)C=1)O

Computed Properties

  • Exact Mass: 214.09942
  • Monoisotopic Mass: 170.013457
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 158
  • 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
  • XLogP3: 2.6
  • Topological Polar Surface Area: 37.3

Experimental Properties

  • Density: 1.298
  • Boiling Point: 270.9°Cat760mmHg
  • Flash Point: 117.6°C
  • PSA: 37.3
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