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352032-26-9 | 3-Methoxy-3'-trifluoromethylbiphenyl
CAS No: 352032-26-9 Catalog No: AG01EVNQ MDL No:
Product Description
Catalog Number:
AG01EVNQ
Chemical Name:
3-Methoxy-3'-trifluoromethylbiphenyl
CAS Number:
352032-26-9
Molecular Formula:
C14H11F3O
Molecular Weight:
252.2317
IUPAC Name:
1-methoxy-3-[3-(trifluoromethyl)phenyl]benzene
InChI:
InChI=1S/C14H11F3O/c1-18-13-7-3-5-11(9-13)10-4-2-6-12(8-10)14(15,16)17/h2-9H,1H3
InChI Key:
GEFKKPVLPNVXQE-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.076g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.236g/mol
Monoisotopic Mass:
252.076g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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