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Key Documents

559016

Sigma-Aldrich

4-Methylhexanoic acid

97%

Synonym(s):

(±)-4-Methylhexanoic acid, 4-Ethylpentanoic acid, 4-Methylcaproic acid, 4-Methylhexanoic acid

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About This Item

Linear Formula:
CH3CH2CH(CH3)CH2CH2COOH
CAS Number:
Molecular Weight:
130.18
EC Number:
MDL number:
UNSPSC Code:
51113400
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

97%

bp

109-112 °C/10 mmHg (lit.)

bulk density

0.921 g/mL

functional group

carboxylic acid

SMILES string

CCC(C)CCC(O)=O

InChI

1S/C7H14O2/c1-3-6(2)4-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)

InChI key

DIVCBWJKVSFZKJ-UHFFFAOYSA-N

pictograms

FlameCorrosion

signalword

Danger

hcodes

Hazard Classifications

Flam. Liq. 3 - Skin Corr. 1B

Storage Class

3 - Flammable liquids

wgk_germany

WGK 2

flash_point_f

110.0 °F - closed cup

flash_point_c

43.33 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter


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