AG002CGZ

199982-02-0 | 1,1'-Biphenyl, 4-butyl-4'-iodo-

AG002CGZ

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CAS Number	199982-02-0
Catalog Number	AG002CGZ(AGN-PC-09RY1E)
Chemical Name	1,1'-Biphenyl, 4-butyl-4'-iodo-
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
MDL Number	MFCD16619281
Molecular Formula	C16H17I
Molecular Weight	336.2106
SMILES	IC1=CC=C(C2=CC=C(CCCC)C=C2)C=C1
Synonyms	4-BUTYL-4'-IODOBIPHENYL, 199982-02-0, 1-butyl-4-(4-iodophenyl)benzene, 4-Butyl-4'-iodo-1,1'-biphenyl, AK-46461, CTK8B8014, KS-00000HRB, C16H17I, DTXSID30697240, 0280AB, ANW-59144, MFCD16619281, ZINC82046886, 1,1'-Biphenyl, 4-butyl-4'-iodo-, AKOS015909737, AS04523, RL02502, AN-30122, DS-13876, AJ-124581, AX8160470, DB-066025, TC-147889, FT-0705359, I14,S1400001, 982B020, J-514855, I14-31778,

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

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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