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Home > Indoles and Oxindole > 89204-85-3
89204-85-3 | 4H-Oxazolo[5,4-b]indole, 4-methyl-2-phenyl-
CAS No: 89204-85-3 Catalog No: AG00446J MDL No:
Product Description
Catalog Number:
AG00446J
Chemical Name:
4H-Oxazolo[5,4-b]indole, 4-methyl-2-phenyl-
CAS Number:
89204-85-3
Molecular Formula:
C16H12N2O
Molecular Weight:
248.2793
IUPAC Name:
4-methyl-2-phenyl-[1,3]oxazolo[5,4-b]indole
InChI:
InChI=1S/C16H12N2O/c1-18-13-10-6-5-9-12(13)14-16(18)19-15(17-14)11-7-3-2-4-8-11/h2-10H,1H3
InChI Key:
CHNGZIUGDRBHEO-UHFFFAOYSA-N
SMILES:
Cn1c2oc(nc2c2c1cccc2)c1ccccc1
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.285g/mol
Monoisotopic Mass:
248.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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