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4-Acetylcyclohexanecarboxylic acid
[CAS# 407628-30-2]

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Identification
Name 4-Acetylcyclohexanecarboxylic acid
Synonyms 4-acetylcyclohexanecarboxylic acid; CYCLOHEXANECARBOXYLICACID, 4-ACETYL-
Molecular Structure CAS#: 407628-30-2, 4-Acetylcyclohexanecarboxylic acid
Molecular Formula C9H14O3
Molecular Weight 170.21
CAS Registry Number 407628-30-2
SMILES O=C(C1CCC(C(=O)O)CC1)C
InChI 1S/C9H14O3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h7-8H,2-5H2,1H3,(H,11,12)
InChIKey ZRKFRUWMDLOXNB-UHFFFAOYSA-N
Properties
Density 1.135g/cm3 (Cal.)
Boiling point 314.465°C at 760 mmHg (Cal.)
Flash point 158.202°C (Cal.)
Refractive index 1.485 (Cal.)
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