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163672-80-8 | 3H-Naphth[2,1-b][1,4]oxazine, 3,3-diphenyl-
CAS No: 163672-80-8 Catalog No: AG001UA9 MDL No:
Product Description
Catalog Number:
AG001UA9
Chemical Name:
3H-Naphth[2,1-b][1,4]oxazine, 3,3-diphenyl-
CAS Number:
163672-80-8
Molecular Formula:
C24H17NO
Molecular Weight:
335.3979
IUPAC Name:
3,3-diphenylbenzo[f][1,4]benzoxazine
InChI:
InChI=1S/C24H17NO/c1-3-10-19(11-4-1)24(20-12-5-2-6-13-20)17-25-23-21-14-8-7-9-18(21)15-16-22(23)26-24/h1-17H
InChI Key:
HTBSVCHLXISATR-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1(C=Nc2c(O1)ccc1c2cccc1)c1ccccc1
Properties
Complexity:
484
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.131g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.406g/mol
Monoisotopic Mass:
335.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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