644-35-9

Name 2-N-PROPYLPHENOL
CAS 644-35-9
EINECS(EC#) 211-415-3
Molecular Formula C9H12O
MDL Number MFCD00002251
Molecular Weight 136.19
MOL File 644-35-9.mol
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Chemical Properties

Appearance CLEAR ORANGE TO SLIGHTLY PURPLE LIQUID
Melting point  7°C
Boiling point  224-226 °C (lit.)
density  0.989 g/mL at 25 °C(lit.)
FEMA  3522
refractive index  n20/D 1.527(lit.)
Fp  200 °F
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
form  clear liquid
pka pK1:10.5 (25°C)
color  Colorless to Light yellow
Odor at 0.10 % in propylene glycol. medicinal phenolic smoky
biological source synthetic
Odor Type phenolic
Water Solubility  1.664g/L(25 ºC)
JECFA Number 695
BRN  1363932
Major Application flavors and fragrances
InChI 1S/C9H12O/c1-2-5-8-6-3-4-7-9(8)10/h3-4,6-7,10H,2,5H2,1H3
InChIKey LCHYEKKJCUJAKN-UHFFFAOYSA-N
SMILES CCCc1ccccc1O
LogP 3.01
CAS DataBase Reference 644-35-9(CAS DataBase Reference)
EPA Substance Registry System o-Propylphenol (644-35-9)
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Safety Data

Hazard Codes  Xn
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36:Wear suitable protective clothing .
RIDADR  UN 3145 8/PG 3
WGK Germany  3
RTECS  SM8600000
TSCA  Yes
HazardClass  8
PackingGroup  III
HS Code  29071190
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Safety Profile
Poison by ingestion. When heated to decomposition it emits acrid smoke and irritating fumes. See also p- PROPYLPHENOL.

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