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1032507-29-1 | 4'-Chloro-3-fluoro-4-methoxy-biphenyl
CAS No: 1032507-29-1 Catalog No: AG01FCV1 MDL No:
Product Description
Catalog Number:
AG01FCV1
Chemical Name:
4'-Chloro-3-fluoro-4-methoxy-biphenyl
CAS Number:
1032507-29-1
Molecular Formula:
C13H10ClFO
Molecular Weight:
236.6693
IUPAC Name:
4-(4-chlorophenyl)-2-fluoro-1-methoxybenzene
InChI:
InChI=1S/C13H10ClFO/c1-16-13-7-4-10(8-12(13)15)9-2-5-11(14)6-3-9/h2-8H,1H3
InChI Key:
YYIMTCNUSNGROV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)c1ccc(cc1)Cl
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.04g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.67g/mol
Monoisotopic Mass:
236.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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