AG002ZJP

30299-08-2 | Butanoic acid, 2,2'-[cyclohexylidenebis(4,1-phenyleneoxy)]bis[2-methyl-

AG002ZJP

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CAS Number	30299-08-2
Catalog Number	AG002ZJP(AGN-PC-0553VM)
Chemical Name	Butanoic acid, 2,2'-[cyclohexylidenebis(4,1-phenyleneoxy)]bis[2-methyl-
IUPAC Name	2-[4-[1-[4-(2-carboxybutan-2-yloxy)phenyl]cyclohexyl]phenoxy]-2-methylbutanoic acid
InChI	InChI=1S/C28H36O6/c1-5-26(3,24(29)30)33-22-14-10-20(11-15-22)28(18-8-7-9-19-28)21-12-16-23(17-13-21)34-27(4,6-2)25(31)32/h10-17H,5-9,18-19H2,1-4H3,(H,29,30)(H,31,32)
InChI Key	BMOVQUBVGICXQN-UHFFFAOYSA-N
MDL Number	MFCD00865769
Molecular Formula	C28H36O6
Molecular Weight	468.5818
SMILES	CCC(OC1=CC=C(C2(C3=CC=C(OC(CC)(C)C(O)=O)C=C3)CCCCC2)C=C1)(C)C(O)=O
UNII	0374EZJ8CU
Synonyms	1,1-bis(4'-(1''-carboxy-1''-methylpropoxy)phenyl)cyclohexane, clinofibrate, clinofibrate, (R*,R*)-(+)-isomer, clinofibrate, (R*,R*)-(+-)-isomer, clinofibrate, (R*,R*)-(-)-isomer, clinofibrate, (R*,S*)-isomer, S 8527, clinofibrate, 30299-08-2, Lipoclin, Clinofibrate [INN:JAN], Clinofibratum [INN-Latin], Clinofibrato [INN-Spanish], UNII-0374EZJ8CU, S 8527, BRN 2230067, 0374EZJ8CU, S-8527, C28H36O6, NCGC00167453-01, NCGC00167453-02, 2,2'-(4,4'-Cyclohexylidenediphenoxy)-2,2'-dimethyldibutyric acid, 2,2'-(Cyclohexylidenebis(4,1-phenyleneoxy))bis(2-methylbutanoic acid), 2,2'-Cyclohexane-1,1-diylbis(p-phenyleneoxy)bis(2-methylbutyric acid), butanoic acid, 2,2'-[cyclohexylidenebis(4,1-phenyleneoxy)]bis[2-methyl-, DSSTox_CID_26638, DSSTox_RID_81784, DSSTox_GSID_46638, Clinofibrato, Clinofibratum, 2,2'-(4,4'-Cyclohexylidenediphenoxy)-2,2'-dimethyldibutanoic Acid, 2,2'-(Cyclohexylidenebis(p-phenyleneoxy))bis(2-methylbutyric acid), Butanoic acid, 2,2'-(cyclohexylidenebis(4,1-phenyleneoxy))bis(2-methyl-, Butyric acid, 2,2'-cyclohexane-1,1-diylbis(p-phenyleneoxy)bis-(2-methyl-, 2,2'-((Cyclohexane-1,1-diylbis(4,1-phenylene))bis(oxy))bis(2-methylbutanoic acid), CAS-30299-08-2, Lipoclin (TN), AC1L1EGT, AC1Q5SUY, Clinofibrate (JP17/INN), SCHEMBL31290, MLS006010186, CHEMBL1897738, DTXSID6046638, CHEBI:31412, CTK4G4822, Lipoclin, 30299-08-2, HMS3656N09, 1,1-bis(4'-(1''-carboxy-1''-methylpropoxy)phenyl)cyclohexane, 2,2'-Dimethyl-2,2'-(4,4'-cyclohexylidendiphenoxy)dibuttersaeure, BCP13269, KS-000017PI, Tox21_112457, MFCD00865769, s2664, AKOS015896391, butanoic acid, 2,2'-(cyclohexylidenebis(4,1-phenyleneoxy))bis(2-methyl), Tox21_112457_1, AC-4728, AN-6546, API0005774, CS-6464, DB09006, VA10611, NCGC00167453-03, AK343610, AS-13842, CC-25910, HY-13528, LS-47934, O720, SMR004701292, FT-0659309, SW220029-1, D01300, J10417, K-7282, 299C082, C-23712, SR-01000944983, I06-1988, SR-01000944983-1, Butanoic acid,2,2'-[cyclohexylidenebis(4,1-phenyleneoxy)]bis[2-methyl-, 2,2-((Cyclohexane-1,1-diylbis(4,1-phenylene))bis(oxy))bis(2-methylbutanoic acid), 2-(4-{1-[4-(1-carboxy-1-methylpropoxy)phenyl]cyclohexyl}phenoxy)-2-methylbutanoic acid, 2-[4-[1-[4-(1-carboxy-1-methyl-propoxy)phenyl]cyclohexyl]phenoxy]-2-methyl-butanoic acid, (2S,2'S)-2,2'-(4,4'-(cyclohexane-1,1-diyl)bis(4,1-phenylene))bis(oxy)bis(2-methylbutanoic acid), 2-[4-[1-[4-(1-hydroxy-2-methyl-1-oxobutan-2-yl)oxyphenyl]cyclohexyl]phenoxy]-2-methylbutanoic acid, clinofibrate, (R*,S*)-isomer, CID2787, AR-1I1060, clinofibrate, (R*,R*)-(+)-isomer, clinofibrate, (R*,R*)-(-)-isomer, C28-H36-O6, clinofibrate, (R*,R*)-(+-)-isomer, C3100, C006231, 2,2'-(Cyclohexylidenebis(4,1-phenyleneoxy))bis(2-methyl)-butanoic acid, 2-[4-[1-[4-(2-carboxybutan-2-yloxy)phenyl]cyclohexyl]phenoxy]-2-methylbutanoic acid, 3137-60-8,

Complexity	633
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	468.251g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	468.59g/mol
Monoisotopic Mass	468.251g/mol
Rotatable Bond Count	10
Topological Polar Surface Area	93.1A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	7.5

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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