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2-Chloro-3,7-Dimethyl-2-Cyclohepten-1-One
[CAS# 499197-94-3]

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Identification
Name 2-Chloro-3,7-Dimethyl-2-Cyclohepten-1-One
Synonyms 2-chloro-3,7-dimethylcyclohept-2-enone
Molecular Structure CAS#: 499197-94-3, 2-Chloro-3,7-Dimethyl-2-Cyclohepten-1-One
Molecular Formula C9H13ClO
Molecular Weight 172.65
CAS Registry Number 499197-94-3
SMILES ClC=1C(=O)C(C)CCCC=1C
InChI 1S/C9H13ClO/c1-6-4-3-5-7(2)9(11)8(6)10/h7H,3-5H2,1-2H3
InChIKey ZCDVIPUYXPIKRO-UHFFFAOYSA-N
Properties
Density 1.072g/cm3 (Cal.)
Boiling point 243.653°C at 760 mmHg (Cal.)
Flash point 125.043°C (Cal.)
Refractive index 1.484 (Cal.)
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