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(+)-Taddol

CAS No.:
93379-49-8
Catalog Number:
AG003BDD
Molecular Formula:
C31H30O4
Molecular Weight:
466.5675
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$32
- +
5g
97%
In Stock USA
United States
$119
- +
25g
97%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG003BDD
Chemical Name:
(+)-Taddol
CAS Number:
93379-49-8
Molecular Formula:
C31H30O4
Molecular Weight:
466.5675
MDL Number:
MFCD00010079
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
SMILES:
OC(c1ccccc1)(c1ccccc1)[C@H]1OC(O[C@@H]1C(c1ccccc1)(c1ccccc1)O)(C)C
Properties
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  
Literature
Title Journal
Massive parallel catalyst screening: toward asymmetric MCRs. Organic letters 20031030
Properties