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89539-12-8 | 1,1'-Biphenyl, 4-(2,2-diethoxy-1-methylethyl)-2'-fluoro-
CAS No: 89539-12-8 Catalog No: AG003Z0J MDL No:
Product Description
Catalog Number:
AG003Z0J
Chemical Name:
1,1'-Biphenyl, 4-(2,2-diethoxy-1-methylethyl)-2'-fluoro-
CAS Number:
89539-12-8
Molecular Formula:
C19H23FO2
Molecular Weight:
302.3831
IUPAC Name:
1-(1,1-diethoxypropan-2-yl)-4-(2-fluorophenyl)benzene
InChI:
InChI=1S/C19H23FO2/c1-4-21-19(22-5-2)14(3)15-10-12-16(13-11-15)17-8-6-7-9-18(17)20/h6-14,19H,4-5H2,1-3H3
InChI Key:
ZXIMPRPBMVZQNR-UHFFFAOYSA-N
SMILES:
CCOC(C(c1ccc(cc1)c1ccccc1F)C)OCC
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.168g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.389g/mol
Monoisotopic Mass:
302.168g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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