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2-Methylphenethyl alcohol

CAT: 0024-sc-225492Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-225492Size:1 g
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CAS Number
19819-98-8

Chemical Information

2-Methylphenethyl alcohol
CAS Number19819-98-8
PubChem CID88267
IUPAC Name2-(2-methylphenyl)ethanol
Molecular FormulaC9H12O
Molecular Weight136.19
XLogP2.3
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity90
SMILES
CC1=CC=CC=C1CCO
InChI
InChI=1S/C9H12O/c1-8-4-2-3-5-9(8)6-7-10/h2-5,10H,6-7H2,1H3
InChIKey
RUGISKODRCWQNE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Methylphenethyl alcohol
CAS: 19819-98-8
CID: 88267
Formula: C9H12O
MW: 136.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight136.19
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass136.088815002
Monoisotopic Mass136.088815002
Topological Polar Surface Area20.2 Ų
Heavy Atom Count10
Formal Charge0
Complexity90.7
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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