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13787-96-7 | Isoxazolidine, 2,3,5-triphenyl-
CAS No: 13787-96-7 Catalog No: AG00140N MDL No:
Product Description
Catalog Number:
AG00140N
Chemical Name:
Isoxazolidine, 2,3,5-triphenyl-
CAS Number:
13787-96-7
Molecular Formula:
C21H19NO
Molecular Weight:
301.3817
IUPAC Name:
2,3,5-triphenyl-1,2-oxazolidine
InChI:
InChI=1S/C21H19NO/c1-4-10-17(11-5-1)20-16-21(18-12-6-2-7-13-18)23-22(20)19-14-8-3-9-15-19/h1-15,20-21H,16H2
InChI Key:
VSFTVFBJKLFFHU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1ON(C(C1)c1ccccc1)c1ccccc1
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.147g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.389g/mol
Monoisotopic Mass:
301.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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