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Key Documents

8.14693

Sigma-Aldrich

(2-tert-Butyl-4-methylcyclohexyl) acetate

(mixture of isomers) for synthesis

Synonym(s):

(2-tert-Butyl-4-methylcyclohexyl) acetate

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About This Item

Empirical Formula (Hill Notation):
C13H24O2
CAS Number:
Molecular Weight:
212.33
UNSPSC Code:
12352108

vapor pressure

<1 hPa ( 50 °C)

form

liquid

autoignition temp.

265 °C (DIN 51794)

potency

>5000 mg/kg LD50, oral (Rat)
>2000 mg/kg LD50, skin (Rat)

pH

7.5 (20 °C, 100 g/L in H2O, as an emulsion)

bp

60-70 °C/0.4 hPa

transition temp

flash point 96 °C (DIN 51758)

density

0.925 g/cm3 at 25 °C

storage temp.

2-30°C

InChI

1S/C13H24O2/c1-9-6-7-12(15-10(2)14)11(8-9)13(3,4)5/h9,11-12H,6-8H2,1-5H3

InChI key

CQAJCSVXUQEABC-UHFFFAOYSA-N

Analysis Note

Assay isomers (GC, area%): ≥ 95.0 % (a/a)
Identity (IR): passes test

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

204.8 °F - DIN 51758

Flash Point(C)

96 °C - DIN 51758


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