200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 137536-94-8
137536-94-8 | 1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-α4,α4,α5,α5-tetra-1-naphthalenyl-, (4R,5R)-
CAS No: 137536-94-8 Catalog No: AG0013J9 MDL No:MFCD00192091
Product Description
Catalog Number:
AG0013J9
Chemical Name:
1,3-Dioxolane-4,5-dimethanol, 2,2-dimethyl-α4,α4,α5,α5-tetra-1-naphthalenyl-, (4R,5R)-
CAS Number:
137536-94-8
Molecular Formula:
C47H38O4
Molecular Weight:
666.8022
MDL Number:
MFCD00192091
IUPAC Name:
[(4R,5R)-5-[hydroxy(dinaphthalen-1-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-dinaphthalen-1-ylmethanol
InChI:
InChI=1S/C47H38O4/c1-45(2)50-43(46(48,39-27-11-19-31-15-3-7-23-35(31)39)40-28-12-20-32-16-4-8-24-36(32)40)44(51-45)47(49,41-29-13-21-33-17-5-9-25-37(33)41)42-30-14-22-34-18-6-10-26-38(34)42/h3-30,43-44,48-49H,1-2H3/t43-,44-/m1/s1
InChI Key:
WTZVNZRNIOJACO-NDOUMJCMSA-N
SMILES:
CC1(C)O[C@H]([C@@H](O1)C(c1cccc2c1cccc2)(c1cccc2c1cccc2)O)C(c1cccc2c1cccc2)(c1cccc2c1cccc2)O
Properties
Complexity:
1020
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
666.277g/mol
Formal Charge:
0
Heavy Atom Count:
51
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
666.817g/mol
Monoisotopic Mass:
666.277g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.