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13323-81-4

13323-81-4 structural image
Product Name: ALPHA-METHYLBENZYL ALCOHOL
Formula: C8H10O
Synonyms: (±)-α-Methylbenzyl alcohol;(±)-1-Phenylethanol;Methyl phenyl carbinol;Styrallyl alcohol;Styrene alcohol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Alpha-methylbenzyl alcohol appears as a colorless liquid. Insoluble in water and less dense than water. Contact may slightly irritate skin, eyes and mucous membranes. May be slightly toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.
Color/Form COLORLESS LIQ
Odor MILD FLORAL ODOR
Boiling Point 399 °F at 745 mmHg (NTP, 1992)
Melting Point 68 °F (NTP, 1992)
Flash Point 185 °F (NTP, 1992)
Solubility less than 1 mg/mL at 67.1 °F (NTP, 1992)
Density 1.015 at 68 °F (USCG, 1999) - Denser than water; will sink
Vapor Density 4.21 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 0.1 mmHg at 68 °F ; 1 mmHg at 120.2 °F; 5 mmHg at 167.4 °F (NTP, 1992)
pH Neutral
Refractive Index Refractive index = 1.525-1.529 at 20 °C
Kovats Retention Index 1043 1027.7 1033.4 1035 1035 1032 1029 1050 1035 1037 1038 1042 1051 1045.1 1042 1036
Other Experimental Properties CONGEALS BELOW ROOM TEMP
Chemical Classes Other Classes -> Alcohols and Polyols, Other

COMPUTED DESCRIPTORS

Molecular Weight 122.16 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 1
Exact Mass 122.073164938 g/mol
Monoisotopic Mass 122.073164938 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 74.6
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Alpha-methylbenzyl alcohol appears as a colorless liquid. Insoluble in water and less dense than water. Contact may slightly irritate skin, eyes and mucous membranes. May be slightly toxic by ingestion, inhalation and skin absorption. Used to make other chemicals.