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1443344-18-0 | 1-(4-Fluoro-3,5-dimethylphenyl)ethanol
CAS No: 1443344-18-0 Catalog No: AG01EU35 MDL No:
Product Description
Catalog Number:
AG01EU35
Chemical Name:
1-(4-Fluoro-3,5-dimethylphenyl)ethanol
CAS Number:
1443344-18-0
Molecular Formula:
C10H13FO
Molecular Weight:
168.2080
IUPAC Name:
1-(4-fluoro-3,5-dimethylphenyl)ethanol
InChI:
InChI=1S/C10H13FO/c1-6-4-9(8(3)12)5-7(2)10(6)11/h4-5,8,12H,1-3H3
InChI Key:
LQRUSNDYQYBWJG-UHFFFAOYSA-N
SMILES:
CC(c1cc(C)c(c(c1)C)F)O
Properties
Complexity:
137
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:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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