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587-03-1

Name 3-Methylbenzyl alcohol
CAS 587-03-1
EINECS(EC#) 209-595-3
Molecular Formula C8H10O
MDL Number MFCD00004646
Molecular Weight 122.16
MOL File 587-03-1.mol
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Chemical Properties

Appearance CLEAR COLOURLESS LIQUID
Melting point  <-20 °C
Boiling point  215 °C740 mm Hg(lit.)
density  1.015 g/mL at 25 °C(lit.)
refractive index  n20/D 1.534(lit.)
RTECS  DA4937010
Fp  222 °F
form  clear liquid
pka 14.63±0.10(Predicted)
color  Colorless to Almost colorless
Specific Gravity 1.02
BRN  2324516
InChI InChI=1S/C8H10O/c1-7-3-2-4-8(5-7)6-9/h2-5,9H,6H2,1H3
InChIKey JJCKHVUTVOPLBV-UHFFFAOYSA-N
SMILES C1(CO)=CC=CC(C)=C1
LogP 1.600
CAS DataBase Reference 587-03-1(CAS DataBase Reference)
NIST Chemistry Reference 3-Methylbenzyl alcohol(587-03-1)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  3
HS Code  29062990

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