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Key Documents

918911

Sigma-Aldrich

4-Methyl-4-mercaptopentan-2-one

≥95.0%

Synonym(s):

4-Mercapto-4-methyl-2-pentanone

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About This Item

Empirical Formula (Hill Notation):
C6H12OS
CAS Number:
Molecular Weight:
132.22
MDL number:
UNSPSC Code:
12352105
NACRES:
NA.22

Quality Level

assay

≥95.0%

form

liquid

functional group

ketone
thiol

storage temp.

2-8°C

SMILES string

CC(=O)CC(C)(C)S

InChI

1S/C6H12OS/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3

InChI key

QRNZMFDCKKEPSX-UHFFFAOYSA-N

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Warning

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

129.2 °F

flash_point_c

54 °C


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