AG003UUP

118164-50-4 | 4-[Trans-4-(trans-4-ethylcyclohexyl)cyclohexyl]-1,2-difluorobenzene

AG003UUP

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CAS Number	118164-50-4
Catalog Number	AG003UUP(AGN-PC-0PBJEU)
Chemical Name	4-[Trans-4-(trans-4-ethylcyclohexyl)cyclohexyl]-1,2-difluorobenzene
IUPAC Name	4-[4-(4-ethylcyclohexyl)cyclohexyl]-1,2-difluorobenzene
InChI	InChI=1S/C20H28F2/c1-2-14-3-5-15(6-4-14)16-7-9-17(10-8-16)18-11-12-19(21)20(22)13-18/h11-17H,2-10H2,1H3
InChI Key	WDECTZREPSJUQW-UHFFFAOYSA-N
MDL Number	MFCD13188635
Molecular Formula	C20H28F2
Molecular Weight	306.4331
SMILES	CC[C@H]1CC[C@H]([C@H]2CC[C@H](C3=CC=C(F)C(F)=C3)CC2)CC1
Synonyms	118164-50-4, trans,trans-4-(3,4-Difluorophenyl)-4'-ethyl-1,1'-bi(cyclohexane), trans,trans-4-(3,4-Difluorophenyl)-4'-ethyl-bicyclohexyl, 4-[trans-4-(trans-4-Ethylcyclohexyl)cyclohexyl]-1,2-difluorobenzene, 4-[4-(4-ethylcyclohexyl)cyclohexyl]-1,2-difluorobenzene, trans,trans-4-(3,4-Difluorophenyl)-4''-ethylbicyclohexyl, trans-4-(3,4-Difluorophenyl)-trans-4'-ethylbicyclohexane, 4-(3,4-Difluorophenyl)-4'-ethyl-1,1'-bi(cyclohexyl), WDECTZREPSJUQW-UHFFFAOYSA-N, AC1LB2XA, trans,trans-4-ethylbicyclohexyl-3,4-difluorobenzene, SCHEMBL3437346, SCHEMBL5683749, SCHEMBL5683754, SCHEMBL6363782, SCHEMBL12314614, SCHEMBL14400737, CTK8B3227, DTXSID10338644, Benzene, 4-(4'-ethyl[1,1'-bicyclohexyl]-4-yl)-1,2-difluoro-, C20H28F2, KS-00000H6N, 2970AA, ANW-42025, MFCD13188635, ZINC55167496, AKOS015900564, AKOS015999141, AKOS024462424, ZINC100003520, ZINC242701410, ZINC263584544, XF10017, 4-[(TRANS,TRANS)-4'-ETHYL[1,1'-BICYCLOHEXYL]-4-YL]-1,2-DIFLUORO-BENZENE, BENZENE, 4-[(TRANS,TRANS)-4'-ETHYL[1,1'-BICYCLOHEXYL]-4-YL]-1,2-DIFLUORO-, AK-40152, AN-32985, DS-13323, AJ-112666, AX8154492, RT-016068, ST2407759, D3856, FT-0657688, 164E504, A803889, I14-0617, J-500351, trans,trans-4-(3,4-Difluorophenyl)-4'-ethylbicyclohexyl, trans-4-(3,4-Difluorophenyl)-trans-4-ethylbicyclohexane, (1R,4R)-4-(3,4-difluorophenyl)-1,1'-bi(cyclohexane), 4-[4-(4-ethylcyclohexyl)cyclohexyl]-1,2-difluoro-benzene, 4-[4-(4-ethylcyclohexyl)cyclohexyl]-1,2-bis(fluoranyl)benzene, 4-[(Trans,trans)-4'-ethyl[1,1'-bicyclohexyl] -4-yl]-1,2-difluorobenzene, 4alpha-Ethyl-4'alpha-(3,4-difluorophenyl)-1beta,1'beta-bicyclohexane, trans,trans-4-(3,4-Difluorophenyl)-4\'-ethyl-1,1\'-bi(cyclohexane), [TRANS(TRANS)]-4-(4'-ETHYL[1,1'-BICYCLOHEXYL]-4-YL)-1,2-DIFLUOROBENZENE, 1~4~-Ethyl-3~3~,3~4~-difluoro-1~1~,1~2~,1~3~,1~4~,1~5~,1~6~,2~1~,2~2~,2~3~,2~4~,2~5~,2~6~-dodecahydro-1~1~,2~1~:2~4~,3~1~-terphenyl, CID550421,

Complexity	327
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	306.216g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	306.441g/mol
Monoisotopic Mass	306.216g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	7.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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