Home Other Building Blocks (Sa,S)-DTB-Ph-SIPHOX

(Sa,S)-DTB-Ph-SIPHOX

CAS No.:
1040274-12-1
Catalog Number:
AG01DH7Z
Molecular Formula:
C54H64NOP
Molecular Weight:
774.0658
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
95%
In Stock USA
United States
$532
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Product Description
Catalog Number:
AG01DH7Z
Chemical Name:
(Sa,S)-DTB-Ph-SIPHOX
CAS Number:
1040274-12-1
Molecular Formula:
C54H64NOP
Molecular Weight:
774.0658
MDL Number:
MFCD31807293
IUPAC Name:
bis(3,5-ditert-butylphenyl)-[(3S)-4-[(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-3,3'-spirobi[1,2-dihydroindene]-4'-yl]phosphane
InChI:
InChI=1S/C54H64NOP/c1-50(2,3)38-28-39(51(4,5)6)31-42(30-38)57(43-32-40(52(7,8)9)29-41(33-43)53(10,11)12)46-23-17-21-37-25-27-54(48(37)46)26-24-36-20-16-22-44(47(36)54)49-55-45(34-56-49)35-18-14-13-15-19-35/h13-23,28-33,45H,24-27,34H2,1-12H3/t45-,54+/m1/s1
InChI Key:
JIDAICRIWADNJH-JWRVDXLXSA-N
SMILES:
CC(c1cc(cc(c1)C(C)(C)C)P(c1cccc2c1[C@@]1(CCc3c1c(ccc3)C1=N[C@H](CO1)c1ccccc1)CC2)c1cc(cc(c1)C(C)(C)C)C(C)(C)C)(C)C
Properties
Complexity:
1300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
773.473g/mol
Formal Charge:
0
Heavy Atom Count:
57  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
774.086g/mol
Monoisotopic Mass:
773.473g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
15.4  
Properties