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CAS Number: 1450-74-4
1-(5-chloro-2-hydroxyphenyl)ethanone

Structure

 1-(5-chloro-2-hydroxyphenyl)ethanone
Name: 1-(5-chloro-2-hydroxyphenyl)ethanone
Synonyms:
General Information
Product Number: 1450744
CAS Registry Number: 1450-74-4
Name:
        Ethanone, 1-​(5-​chloro-​2-​hydroxyphenyl)​-
        Acetophenone, 5'-​chloro-​2'-​hydroxy- (6CI,​7CI,​8CI); 1-​(5-​Chloro-​2-​hydroxyphenyl)​ethanone; 2-​Acetyl-​4-​chlorophenol; 2'-​Hydroxy-​5'-​chloroacetophenone; 3-​Chloro-​6-​hydroxyacetophenone; 5'-​Chloro-​2'-​hydroxyacetophenone; NSC 46622 
        Deleted CAS Registry Numbers: 1039416-​31-​3
 
Chemical Formula: C8H7ClO2
Exact Mass: 170.01
Molecular Weight: 170.59
m/z: 170.01 (100.0%), 172.01 (32.0%), 171.02 (8.8%), 173.01 (2.8%)
Elemental Analysis: C, 56.32; H, 4.14; Cl, 20.78; O, 18.76
 
InChI: InChI=1S/C8H7ClO2/c1-5(10)7-4-6(9)2-3-8(7)11/h2-4,11H,1H3
InChIKey: XTGCUDZCCIRWHL-UHFFFAOYSA-N
Canonical SMILES : CC(=O)C1=C(C=CC(=C1)Cl)O
 
Thermal Properties Value Condition Note
Boiling Point 126-128 °C Press: 28 Torr (1)CAS
Boiling Point 125-126 °C Press: 14 Torr (2)CAS
Boiling Point 98 °C Press: 15 Torr (3)IC
Melting Point 54 °C   (2)CAS
Melting Point 54 °C Solv: methanol (67-56-1) (11)CAS
 

Specification

98%
References
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  4. (4) BIORAD: Copyright Bio-Rad Laboratories. All Rights Reserved.
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  8. (8) BIORAD: Infrared spectral data from the Bio-Rad/Sadtler IR Data Collection was obtained from Bio-Rad Laboratories, Philadelphia, PA (US). Copyright © Bio-Rad Laboratories. All Rights Reserved.
  9. (9) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
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