4-ISOPROPYLCYCLOHEXANONE CAS#: 5432-85-9

4-ISOPROPYLCYCLOHEXANONE Basic information

Product Name:

4-ISOPROPYLCYCLOHEXANONE

Synonyms:

TIMTEC-BB SBB007754
4-(1-methylethyl)-cyclohexanon
Cyclohexanone, 4-(1-methylethyl)-
Cyclohexanone, 4-isopropyl-
4-isopropylcyclohexan-1-one
4-ISOPROPYLCYCLOHEXANONE 95%
4-Isopropylcyclohexane-1-one
4-ISOPROPYLCYCLOHEXANONE

CAS:

5432-85-9

MF:

C9H16O

MW:

140.22

EINECS:

226-592-2

Mol File:

5432-85-9.mol

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4-ISOPROPYLCYCLOHEXANONE Chemical Properties

Melting point:: 32.57°C (estimate)
Boiling point:: 94-96°C 17mm
Density: 0.9099
refractive index: 1.458
Flash point:: 80°C
storage temp.: Inert atmosphere,Room Temperature
solubility: Chloroform, Ethyl Acetate
form: Oil
color: Clear Colorless
Water Solubility: Soluble in alcohol. Insoluble in water.
BRN: 1236952
InChI: InChI=1S/C9H16O/c1-7(2)8-3-5-9(10)6-4-8/h7-8H,3-6H2,1-2H3
InChIKey: FPKISACHVIIMRA-UHFFFAOYSA-N
SMILES: C1(=O)CCC(C(C)C)CC1
LogP: 2.219 (est)
CAS DataBase Reference: 5432-85-9(CAS DataBase Reference)
EPA Substance Registry System: Cyclohexanone, 4-(1-methylethyl)- (5432-85-9)

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Safety Information

Hazard Codes: Xi
Risk Statements: 37/38-41
Safety Statements: 23-24/25-39-26
TSCA: T
HS Code: 2914290090

MSDS

Language:English Provider:ALFA

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4-ISOPROPYLCYCLOHEXANONE Usage And Synthesis

Uses

4-Isopropylcyclohexanone is used to prepare 4-isopropyl-cyclohexanone oxime. It is also used in the synthesis of dihydroindol-2-ones as agonists and antagonist ligands at the nociceptin receptor. Further, it is used in the preparation of beta-alanine derivatives, which acts as orally available glucagon receptor antagonists.

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