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199982-02-0 | 1,1'-Biphenyl, 4-butyl-4'-iodo-
CAS No: 199982-02-0 Catalog No: AG002CGZ MDL No:MFCD16619281
Product Description
Catalog Number:
AG002CGZ
Chemical Name:
1,1'-Biphenyl, 4-butyl-4'-iodo-
CAS Number:
199982-02-0
Molecular Formula:
C16H17I
Molecular Weight:
336.2107
MDL Number:
MFCD16619281
IUPAC Name:
1-butyl-4-(4-iodophenyl)benzene
InChI:
InChI=1S/C16H17I/c1-2-3-4-13-5-7-14(8-6-13)15-9-11-16(17)12-10-15/h5-12H,2-4H2,1H3
InChI Key:
KTEKHPDWAMYUBP-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)c1ccc(cc1)I
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.037g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.216g/mol
Monoisotopic Mass:
336.037g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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