Home Other Building Blocks (2R,2'R,3R,3'R)-4,4'-Di-9-anthracenyl-3,3'-bis(1,1-dimethylethyl)-2,2',3,3'-tetrahydro-2,2'-bi-1,3-benzoxaphosphole

(2R,2'R,3R,3'R)-4,4'-Di-9-anthracenyl-3,3'-bis(1,1-dimethylethyl)-2,2',3,3'-tetrahydro-2,2'-bi-1,3-benzoxaphosphole

CAS No.:
1884680-45-8
Catalog Number:
AG01D8ZI
Molecular Formula:
C50H44O2P2
Molecular Weight:
738.8307
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Product Description
Catalog Number:
AG01D8ZI
Chemical Name:
(2R,2'R,3R,3'R)-4,4'-Di-9-anthracenyl-3,3'-bis(1,1-dimethylethyl)-2,2',3,3'-tetrahydro-2,2'-bi-1,3-benzoxaphosphole
CAS Number:
1884680-45-8
Molecular Formula:
C50H44O2P2
Molecular Weight:
738.8307
MDL Number:
MFCD31630707
IUPAC Name:
(2R,3R)-4-anthracen-9-yl-2-[(2R,3R)-4-anthracen-9-yl-3-tert-butyl-2H-1,3-benzoxaphosphol-2-yl]-3-tert-butyl-2H-1,3-benzoxaphosphole
InChI:
InChI=1S/C50H44O2P2/c1-49(2,3)53-45-39(43-35-21-11-7-17-31(35)29-32-18-8-12-22-36(32)43)25-15-27-41(45)51-47(53)48-52-42-28-16-26-40(46(42)54(48)50(4,5)6)44-37-23-13-9-19-33(37)30-34-20-10-14-24-38(34)44/h7-30,47-48H,1-6H3/t47-,48-,53-,54-/m1/s1
InChI Key:
HDNWNMANFZGXKV-ZYCFLHCNSA-N
SMILES:
CC(P1[C@@H](Oc2c1c(ccc2)c1c2ccccc2cc2c1cccc2)[C@@H]1Oc2c(P1C(C)(C)C)c(ccc2)c1c2ccccc2cc2c1cccc2)(C)C
Properties
Complexity:
1160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
738.282g/mol
Formal Charge:
0
Heavy Atom Count:
54  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
738.848g/mol
Monoisotopic Mass:
738.282g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12.8  
Properties