AG003NRI

110726-28-8 | ALPHA,ALPHA,ALPHA'-TRIS(4-HYDROXYPHENYL)-1-ETHYL-4-ISOPROPYLBENZENE

AG003NRI

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CAS Number	110726-28-8
Catalog Number	AG003NRI(AGN-PC-0P11G9)
Chemical Name	ALPHA,ALPHA,ALPHA'-TRIS(4-HYDROXYPHENYL)-1-ETHYL-4-ISOPROPYLBENZENE
EC Number	425-600-3
IUPAC Name	4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol
InChI	InChI=1S/C29H28O3/c1-28(2,21-8-14-25(30)15-9-21)20-4-6-22(7-5-20)29(3,23-10-16-26(31)17-11-23)24-12-18-27(32)19-13-24/h4-19,30-32H,1-3H3
InChI Key	WXYSZTISEJBRHW-UHFFFAOYSA-N
MDL Number	MFCD00191685
Molecular Formula	C29H28O3
Molecular Weight	424.5308
SMILES	CC(C)(C1=CC=C(O)C=C1)C1=CC=C(C=C1)C(C)(C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
Synonyms	110726-28-8, 4,4'-(1-(4-(2-(4-hydroxyphenyl)propan-2-yl)phenyl)ethane-1,1-diyl)diphenol, WXYSZTISEJBRHW-UHFFFAOYSA-N, alpha,alpha,alpha'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene, AK-56207, Phenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis-, Trisphenol PA, Phenol, 4,4'-(1-(4-(1-(4-hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)bis-, AC1LCOKR, EC 425-600-3, SCHEMBL35973, triphenylmethane derivative, 6, CHEMBL455575, DTXSID3073052, BDBM29334, CTK8B7920, KS-00000YUN, WXYSZTISEJBRHW-UHFFFAOYSA-, ANW-58940, MFCD00191685, ZINC32292067, 4,4'-(1-(p-(4-Hydroxy-alpha,alpha-dimethylbenzyl)phenyl)ethylidene)diphenol, AJ-85174, DA-47855, AX8113281, FT-0754772, ST24028647, I14-90651, 4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol, alpha,alpha,alpha-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene, 1-[1-(4-hydroxyphenyl)isopropyl]-4-[1,1-bis(4-hydroxyphenyl)ethyl]benzene, 4,4'-(1-(4-(1-(4-Hydroxyphenyl)-1-methylethyl)phenyl)ethylidene)diphenol, 4,4'-[1-[4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bisphenol, 4-[1-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]-1-methyl-ethyl]phenol, 4-[4-[1,1-Bis(4-hydroxyphenyl)ethyl]-alpha,alpha-dimethylbenzyl]phenol, 4-[4-[1,1-Bis(4-hydroxyphenyl)ethyl]]-alpha,alpha-dimethylbenzylphenol, 4,4''-(1-(4-(2-(4-Hydroxyphenyl)Propan-2-Yl)Phenyl)Ethane-1,1-Diyl)Diphenol, 4,4'-[1-[4-[1-(4-Hydroxyphenyl)-1-methylethyl]phenyl]ethylidene]bis(phenol), 4-[1-(4-hydroxyphenyl)-1-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]ethyl]phenol, InChI=1/C29H28O3/c1-28(2,21-8-14-25(30)15-9-21)20-4-6-22(7-5-20)29(3,23-10-16-26(31)17-11-23)24-12-18-27(32)19-13-24/h4-19,30-32H,1-3H3, Polyphenol, CID634278, ACN-048263, C29-H28-O3, T1428, ,,\'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene, a,a,a'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene, 4,4'-(1-{4-[1-(4-hydroxyphenyl)-1-methylethyl]phenyl}ethylidene)diphenol, 4,4'-[1-[4-[2-(4-Hydroxyphenyl)propan-2-yl]phenyl]ethy lidene]diphenol, alpha,alpha,alpha'-Tris(4-hydroxyphenyl)-1-ethyl-4-isopropylbenzene, 98% - 25G 25g,

Complexity	547
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	424.204g/mol
Formal Charge	0
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	424.54g/mol
Monoisotopic Mass	424.204g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	60.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number