628-46-6

Name 5-METHYLHEXANOIC ACID
CAS 628-46-6
Molecular Formula C7H14O2
MDL Number MFCD00036494
Molecular Weight 130.18
MOL File 628-46-6.mol
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Chemical Properties

Melting point  -55.77°C (estimate)
Boiling point  216°C
density  0,91 g/cm3
FEMA  3572
Fp  >100°C
refractive index  1.4220
form  liquid
pka 4.78±0.10(Predicted)
Odor at 10.00 % in propylene glycol. fatty cheese oily fruity
Odor Type fatty
Water Solubility  Slightly soluble in water.
JECFA Number 266
InChI 1S/C7H14O2/c1-6(2)4-3-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
InChIKey MHPUGCYGQWGLJL-UHFFFAOYSA-N
SMILES CC(C)CCCC(O)=O
LogP 2.19
CAS DataBase Reference 628-46-6(CAS DataBase Reference)
EPA Substance Registry System Hexanoic acid, 5-methyl- (628-46-6)

Safety Data

Hazard Codes  Xi
Risk Statements 
R34:Causes burns.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
RIDADR  3265
WGK Germany  WGK 3
RTECS  MO8400900
TSCA  Yes
HazardClass  8
PackingGroup  II
HS Code  2915907098
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Dam. 1

Hazard Information

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