AG003KF3

7168-54-9 | 4,4-Diethoxybiphenyl

AG003KF3

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CAS Number	7168-54-9
Catalog Number	AG003KF3(AGN-PC-0JTVR7)
Chemical Name	4,4-Diethoxybiphenyl
IUPAC Name	1-ethoxy-4-(4-ethoxyphenyl)benzene
InChI	InChI=1S/C16H18O2/c1-3-17-15-9-5-13(6-10-15)14-7-11-16(12-8-14)18-4-2/h5-12H,3-4H2,1-2H3
InChI Key	WTLUUYXFCHWUJK-UHFFFAOYSA-N
MDL Number	MFCD05864686
Molecular Formula	C16H18O2
Molecular Weight	242.3129
SMILES	CCOC1=CC=C(C2=CC=C(OCC)C=C2)C=C1
Synonyms	4,4'-Diethoxybiphenyl, 7168-54-9, 4,4'-Diethoxy-1,1'-biphenyl, 1-ethoxy-4-(4-ethoxyphenyl)benzene, 1,1'-Biphenyl,4,4'-diethoxy-, 4,4'-Biphenetol, 4,4'-Biphenetole, 4,4-diethoxybiphenyl, PubChem9096, AC1LDGAV, ACMC-209ojp, SCHEMBL5833291, CTK5D4865, DTXSID30347112, WTLUUYXFCHWUJK-UHFFFAOYSA-N, ZINC396683, 1,1'-Biphenyl, 4,4'-diethoxy-, 4,4'-Diethoxy-1,1'-biphenyl #, ANW-36083, MFCD00026801, AKOS004907235, MCULE-2044694112, VZ35240, CC-17142, ZB012692, TR-023547, D1127, FT-0636378, A837286, C-14626, I14-3934, CID617993, ZINC00396683,

Complexity	189
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	242.131g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	242.318g/mol
Monoisotopic Mass	242.131g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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