96-17-3

Name 2-Methylbutyraldehyde
CAS 96-17-3
EINECS(EC#) 202-485-6
Molecular Formula C5H10O
MDL Number MFCD00006984
Molecular Weight 86.13
MOL File 96-17-3.mol

Chemical Properties

Appearance clear colourless liquid
Melting point  -67.38°C (estimate)
Boiling point  90-92 °C (lit.)
density  0.804 g/mL at 25 °C(lit.)
FEMA  2691
refractive index  n20/D 1.3919(lit.)
Fp  40 °F
storage temp.  Flammables area
solubility  soluble in Chloroform, Methanol
form  Liquid
color  Clear colorless
Odor at 1.00 % in dipropylene glycol. musty cocoa phenolic coffee nutty malty fermented fatty alcoholic
biological source synthetic
explosive limit 1.3-13%(V)
Odor Type cocoa
Optical Rotation -0.13°(C=1.00 g/100ml,CHCL3)
Water Solubility  Soluble in water, ether, and alcohol.
Sensitive  Air Sensitive
JECFA Number 254
BRN  1633540
Henry's Law Constant 2.5×10-2 mol/(m3Pa) at 25℃, Brockbank (2013)
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C5H10O/c1-3-5(2)4-6/h4-5H,3H2,1-2H3
InChIKey BYGQBDHUGHBGMD-UHFFFAOYSA-N
SMILES [H]C(=O)C(C)CC
LogP 1.23 at 25℃
Uses
Flavoring.
CAS DataBase Reference 96-17-3(CAS DataBase Reference)
NIST Chemistry Reference Butanal, 2-methyl-(96-17-3)
EPA Substance Registry System 96-17-3(EPA Substance)

Safety Data

Symbol(GHS)  Flame (GHS02)Exclamation Mark (GHS07)Environment (GHS09)
GHS02,GHS07,GHS09
Signal word  Danger
Hazard statements  H225-H317-H319-H335-H411
Precautionary statements  P210-P233-P273-P280-P303+P361+P353-P305+P351+P338
Hazard Codes  F,Xi
Risk Statements 
R11:Highly Flammable.
R36:Irritating to the eyes.
Safety Statements 
S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S39:Wear eye/face protection .
RIDADR  UN 3371 3/PG 2
WGK Germany  1
RTECS  ES3400000
10-23
TSCA  Yes
REACH Registrations Active
HazardClass  3
PackingGroup  II
HS Code  29121900
Storage Class 3 - Flammable liquids
Hazard Classifications Aquatic Chronic 2
Eye Irrit. 2
Flam. Liq. 2
Skin Sens. 1
STOT SE 3

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

Well-known Reagent Company Product Information

Supplier