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CAS Number: 14548-38-0
6-chloro-2,3-dihydro-1H-inden-1-one

Structure

 6-chloro-2,3-dihydro-1H-inden-1-one
Name: 6-chloro-2,3-dihydro-1H-inden-1-one
Synonyms:
General Information
Product Number: 14548380

CAS Registry Number 14548-38-0
Name:
1H-?Inden-?1-?one, 6-?chloro-?2,?3-?dihydro-
1-Indanone, 6-chloro- (6CI,7CI,8CI)
6-Chloro-1-indanone
6-Chloro-2,3-dihydro-1H-inden-1-one

 

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/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5H,2,4H2

InChI Key:SMSGJDOJSQHQIW-UHFFFAOYSA-N

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

 

Thermal Properties Value Condition Note
Boiling Point 110 °C Press: 0.01 Torr (1)IC
Melting Point 81 °C   (6)CAS
Melting Point 80-82 °C   (4)CAS
Melting Point 79-80 °C   (7)CAS
Melting Point 79-80 °C   (8)CAS
Melting Point 79 °C Solv: cyclohexane (110-82-7) (9)IC
Melting Point 72 °C   (1)IC

Specification

98%
References
  1. (1) Flammang, Michel; European Journal of Medicinal Chemistry 1976, V11(1), P83-7 CAPLUS
  2. (4) Lan, Kun; Synthetic Communications 2007, V37(13), P2171-2177 CAPLUS
  3. (6) Seka, Reinhard; Berichte der Deutschen Chemischen Gesellschaft [Abteilung] B: Abhandlungen 1942, V75B, P1730-8 CAPLUS
  4. (7) Nesmeyanov, A. N.; Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya 1955, P993-8 CAPLUS
  5. (8) Mirek, Julian; Roczniki Chemii 1961, V35, P533-9 CAPLUS
  6. (9) Strehlke, P.; Archiv der Pharmazie (Weinheim, Germany) 1975, V308(2), P94-109 CAPLUS
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