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CAS Number: 53590-47-9
(5-chloro-1H-indol-2-yl)methanol

Structure

(5-chloro-1H-indol-2-yl)methanol
Name: (5-chloro-1H-indol-2-yl)methanol
Synonyms:
General Information
Product Number: 53590479
CAS Registry Number: 53590-47-9
Name:
        1H-​Indole-​2-​methanol, 5-​chloro-
        (5-​Chloro-​1H-​indol-​2-​yl)​methanol; 5-​Chloro-​1H-​indole-​2-​methanol 
 
Chemical Formula: C9H8ClNO
Exact Mass: 181.03
Molecular Weight: 181.62
m/z: 181.03 (100.0%), 183.03 (32.2%), 182.03 (10.1%), 184.03 (3.2%)
Elemental Analysis: C, 59.52; H, 4.44; Cl, 19.52; N, 7.71; O, 8.81
 
InChI: InChI=1S/ClH/h1H
InChIKey: VEXZGXHMUGYJMC-UHFFFAOYSA-N
Canonical SMILES : Cl
 
Thermal Properties Value Condition Note
Melting Point 115-117 °C Solv: ethyl acetate (141-78-6) (1)CAS
Melting Point 112-113 °C   (2)CAS

Specification

98%

References
  1. (1) Narayana, B.; Organic Chemistry: An Indian Journal 2006, V2(1-3), P5-9 CAPLUS
  2. (2) An, Jing; Chemical Communications (Cambridge, United Kingdom) 2011, V47(6), P1869-1871 CAPLUS
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