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CAS Number: 34911-25-6
7-chloro-2,3-dihydro-1H-inden-1-one

Structure

 7-chloro-2,3-dihydro-1H-inden-1-one
Name: 7-chloro-2,3-dihydro-1H-inden-1-one
Synonyms:
General Information
Product Number: 34911256

CAS Registry Number 34911-25-6
Name:
1H-?Inden-?1-?one, 7-?chloro-?2,?3-?dihydro-
7-Chloro-2,3-dihydro-1H-inden-1-one
7-Chloro-1-indanone

 

Chemical Formula: C9H7ClO
Exact Mass: 166.02
Molecular Weight: 166.60
m/z: 166.02 (100.0%), 168.02 (32.2%), 167.02 (9.9%), 169.02 (3.1%)

 

InChI:InChI=1S/C9H7ClO/c10-7-3-1-2-6-4-5-8(11)9(6)7/h1-3H,4-5H2

InChI Key:YNFZQNGHYQYLCF-UHFFFAOYSA-N

Canonical SMILES:C1CC(=O)C2=C1C=CC=C2Cl

 

Thermal Properties Value Condition Note
Melting Point 98 °C   (1)CAS
Melting Point 94.8-95.8 °C   (2)CAS
Melting Point 92-93.5 °C   (3)IC

Specification

98%
References
  1. (1) Kenner, James; Journal of the Chemical Society, Transactions 1921, V119, P1452-61 CAPLUS
  2. (2) Fieser, Louis F.; Journal of the American Chemical Society 1952, V74, P536-7 CAPLUS
  3. (3) Tian, Guan Rong; Bulletin of the Chemical Society of Japan 1988, V61(7), P2393-9 CAPLUS
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