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3762-40-1 | 1-(3-Fluorophenyl)-2-methyl-2-propanol
CAS No: 3762-40-1 Catalog No: AG01EVQZ MDL No:
Product Description
Catalog Number:
AG01EVQZ
Chemical Name:
1-(3-Fluorophenyl)-2-methyl-2-propanol
CAS Number:
3762-40-1
Molecular Formula:
C10H13FO
Molecular Weight:
168.2080
IUPAC Name:
1-(3-fluorophenyl)-2-methylpropan-2-ol
InChI:
InChI=1S/C10H13FO/c1-10(2,12)7-8-4-3-5-9(11)6-8/h3-6,12H,7H2,1-2H3
InChI Key:
RHWDAYIPFFQDOU-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)CC(O)(C)C
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.211g/mol
Monoisotopic Mass:
168.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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