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1000548-63-9 | Benzeneethanol, 5-fluoro-2-methyl-
CAS No: 1000548-63-9 Catalog No: AG0000QL MDL No:
Product Description
Catalog Number:
AG0000QL
Chemical Name:
Benzeneethanol, 5-fluoro-2-methyl-
CAS Number:
1000548-63-9
Molecular Formula:
C9H11FO
Molecular Weight:
154.1814
IUPAC Name:
2-(5-fluoro-2-methylphenyl)ethanol
InChI:
InChI=1S/C9H11FO/c1-7-2-3-9(10)6-8(7)4-5-11/h2-3,6,11H,4-5H2,1H3
InChI Key:
VSESPILKVTVKTF-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1CCO)F
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.184g/mol
Monoisotopic Mass:
154.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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