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Home > Other Heterocycles > 74111-37-8
74111-37-8 | 3,9-diphenyl-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane 3,9-dioxide
CAS No: 74111-37-8 Catalog No: AG005HHE MDL No:
Product Description
Catalog Number:
AG005HHE
Chemical Name:
3,9-diphenyl-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane 3,9-dioxide
CAS Number:
74111-37-8
Molecular Formula:
C17H18O6P2
Molecular Weight:
380.2687
IUPAC Name:
(1S,2R,6S,7R)-4-(dimethylamino)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
InChI:
InChI=1S/C11H14N2O2/c1-12(2)13-10(14)8-6-3-4-7(5-6)9(8)11(13)15/h3-4,6-9H,5H2,1-2H3/t6-,7+,8-,9+
InChI Key:
XVMSRSMVAUOQCB-SPJNRGJMSA-N
SMILES:
O=P1(OCC2(CO1)COP(=O)(OC2)c1ccccc1)c1ccccc1
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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