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Home > Aldehydes > 104968-03-8
104968-03-8 | 4-Oxo-3,4-dihydroquinazoline-2-carbaldehyde
CAS No: 104968-03-8 Catalog No: AG0094OF MDL No:
Product Description
Catalog Number:
AG0094OF
Chemical Name:
4-Oxo-3,4-dihydroquinazoline-2-carbaldehyde
CAS Number:
104968-03-8
IUPAC Name:
4-oxo-3H-quinazoline-2-carbaldehyde
InChI:
InChI=1S/C9H6N2O2/c12-5-8-10-7-4-2-1-3-6(7)9(13)11-8/h1-5H,(H,10,11,13)
InChI Key:
WRESPKSRAUTUGF-UHFFFAOYSA-N
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.159g/mol
Monoisotopic Mass:
174.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
Literature
| Title | Journal |
|---|---|
| A flexible synthesis of 2,3-disubstituted indoles from aminobenzyl phosphonium salts. A direct synthesis of rutaecarpine. | The Journal of organic chemistry 20090807 |
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