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79074-23-0 | 10,11-dihydrophenanthro[2,1-d][1,2]oxazole
CAS No: 79074-23-0 Catalog No: AG008N20 MDL No:
Product Description
Catalog Number:
AG008N20
Chemical Name:
10,11-dihydrophenanthro[2,1-d][1,2]oxazole
CAS Number:
79074-23-0
Molecular Formula:
C15H11NO
Molecular Weight:
221.2539
IUPAC Name:
10,11-dihydronaphtho[1,2-g][1,2]benzoxazole
InChI:
InChI=1S/C15H11NO/c1-2-4-12-10(3-1)5-8-14-13(12)7-6-11-9-16-17-15(11)14/h1-5,8-9H,6-7H2
InChI Key:
QATGRXVNDSBMFE-UHFFFAOYSA-N
SMILES:
n1cc2c(o1)c1ccc3c(c1CC2)cccc3
NSC Number:
147714
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.084g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.259g/mol
Monoisotopic Mass:
221.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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