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Structure

(2R,3R)-1,1,4,4-Tetraphenyl-2,3-O-(1-phenylethylidene)-1,2,3,4-butanetetrol

CAS
109306-21-0
Catalog Number
ACM109306210
Category
Other Products
Molecular Weight
528.648g/mol
Molecular Formula
C36H32O4;

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Specification

Synonyms
2-Methyl-2,alpha,alpha,alpha',alpha'-pentaphenyl-1,3-dioxolane-4beta,5alpha-dimethanol; [(4R,5R)-2-Methyl-2-phenyl-1,3-dioxolane-4,5-diyl]bis(diphenylmethanol); (2R,3R)-1,1,4,4-Tetraphenyl-2,3-O-(1-phenylethylidene)-1,2,3,4-butanetetrol; ((4R,5R)-2-Methyl-2-phenyl-1,3-dioxolane-4,5-diyl)bis(diphenylmethanol); TR-002043; (2R,3R)-2,3-O-(1-Phenylethylidene)-1,1,4,4-tetraphenyl-1,2,3,4-butanetetrol; (4R,5R)-2-Methyl-a,a,a\',a\',2-pentaphenyl-1,3-dioxolane-4,5-dimethanol; J-002265;
IUPAC Name
[(4R,5R)-5-[hydroxy(diphenyl)methyl]-2-methyl-2-phenyl-1,3-dioxolan-4-yl]-diphenylmethanol;
Canonical SMILES
CC1(OC(C(O1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O)C6=CC=CC=C6;
InChI
InChI=1S/C36H32O4/c1-34(27-17-7-2-8-18-27)39-32(35(37,28-19-9-3-10-20-28)29-21-11-4-12-22-29)33(40-34)36(38,30-23-13-5-14-24-30)31-25-15-6-16-26-31/h2-26,32-33,37-38H,1H3/t32-,33-/m1/s1;
InChI Key
QVQMFUMIQACODH-CZNDPXEESA-N;
Complexity
691
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
2
Exact Mass
528.23g/mol
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
40
Monoisotopic Mass
528.23g/mol
Rotatable Bond Count
7
Topological Polar Surface Area
58.9A^2
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