AG003BDD

93379-49-8 | (+)-4,5-Bis[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolane

AG003BDD

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CAS Number	93379-49-8
Catalog Number	AG003BDD(AGN-PC-04QTOU)
Chemical Name	(+)-4,5-Bis[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolane
IUPAC Name	[(4S,5S)-5-[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-diphenylmethanol
InChI	InChI=1S/C31H30O4/c1-29(2)34-27(30(32,23-15-7-3-8-16-23)24-17-9-4-10-18-24)28(35-29)31(33,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22,27-28,32-33H,1-2H3/t27-,28-/m0/s1
InChI Key	OWVIRVJQDVCGQX-NSOVKSMOSA-N
MDL Number	MFCD00010079
Molecular Formula	C31H30O4
Molecular Weight	466.5675
SMILES	CC1(C)O[C@H](C(C2=CC=CC=C2)(C3=CC=CC=C3)O)[C@@H](C(C4=CC=CC=C4)(C5=CC=CC=C5)O)O1
Synonyms	93379-49-8, (+)-Taddol, ((4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-diyl)bis(diphenylmethanol), (+)-4,5-Bis[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolane, (+)-2,3-O-Isopropylidene-1,1,4,4-tetraphenyl-D-threitol, (4S,5S)-2,2-Dimethyl-alpha,alpha,alpha',alpha'-tetraphenyldioxolane-4,5-dimethanol, (4S,5S)-4,5-Bis(diphenylhydroxymethyl)-2,2-dimethyldioxolane, (+)-trans-Alpha,alpha'-(2,2-dimethyl-1,3-dioxolane-4,5-diyl)bis(diphenylmethanol), C31H30O4, [(4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-diyl]bis(diphenylmethanol), OWVIRVJQDVCGQX-NSOVKSMOSA-N, (4S,5S)-2,2-Dimethyl-lla pound inverted question marka pound inverted question marketraphenyldioxolane-4,5-dimethanol, AK-54573, (S,s)-taddol, PubChem6769, SCHEMBL4383952, KS-00000VWJ, ZINC6569118, ANW-57720, CD-655, KM3190, MFCD00010079, AM62783, CS-W013767, SC11819, AJ-56381, AS-11054, OR315318, SC-49169, AB1011168, AX8009294, TC-146465, FT-0642241, ST24033382, 379B498, 1,1,4,4-Tetraphenyl-2-O,3-O-isopropylidene-D-threitol, (2S,3S)-2,3-O-Isopropylidene-1,1,4,4-tetraphenyl-1,2,3,4-butanetetrol, TRANS-(2,2-DIMETHYL-1,3-DIOXOLANE-4,5-DIYL)BIS(DIPHENYLMETHANOL), (+)-TRANS-4,5-BIS-(DIPHENYL-HYDROXYMETHYL)-2,2-DIMETHYL-1,3-DIOXOLANE, (+)-TRANS-ALPHA,ALPHA-(2,2-DIMETHYL-1,3-DIOXOLANE-4,5-DIYL)BIS(DIPHENYLMETHANOL), (4S,5S)-2,2-DIMETHYL-A,A,A',A'-TETRAPHENYLDIOXOLANE-4,5-DIMETHANOL, (4S,5S)-2,2-Dimethyl-alpha,alpha,alpha',alpha'-tetraphenyldioxolane-4,5-dimethanol, 97%, [(4S,5S)-5-(hydroxydiphenylmethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]diphenylmethanol, [(4S,5S)-5-[hydroxy(diphenyl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-diphenylmethanol, (+)-2,3-O-Isopropylidene-1,1,4,4-tetraphenyl-D-threitol;(2S,3S)-2,3-O-Isopropylidene-1,1,4,4-tetraphenyl-1,2,3,4-butanetetrol, (+)-trans-|A,|A inverted exclamation marka-(2,2-Dimethyl-1,3-dioxolane-4,5-diyl)bis(diphenylmethanol), (4S,5S)-2,2-Dimethyl-|A,|A,|A inverted exclamation marka,|A inverted exclamation marka-tetraphenyldioxolane-4,5-dimethanol, 1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-alpha4,alpha4,alpha5,alpha5-tetraphenyl-, (4S,5S)-, ZINC02539295, ACN-036146, CB11164, CID9852051, B2048, (4S,5S)-2,2-dimethyl-,,','-tetraphenyl-1,3-dioxolan-4,5-dimethanol, (4S,5S)-2,2-Dimethyl-|A,|A,|A inverted exclamation marka,|A inverted exclamation marka-tetraphenyldioxolane-4, 5-dimethanol, 1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-.alpha.,.alpha.,.alpha.',.alpha.'-tetraphenyl-, (4S,5S)-,

Complexity	574
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	466.214g/mol
Formal Charge	0
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	466.577g/mol
Monoisotopic Mass	466.214g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	58.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	5.2

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

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