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Home > Aldehydes > 130161-46-5
130161-46-5 | 5-Pyrimidinecarboxaldehyde, 2-phenyl-
CAS No: 130161-46-5 Catalog No: AG000U2H MDL No:MFCD03085924
Product Description
Catalog Number:
AG000U2H
Chemical Name:
5-Pyrimidinecarboxaldehyde, 2-phenyl-
CAS Number:
130161-46-5
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
MDL Number:
MFCD03085924
IUPAC Name:
2-phenylpyrimidine-5-carbaldehyde
InChI:
InChI=1S/C11H8N2O/c14-8-9-6-12-11(13-7-9)10-4-2-1-3-5-10/h1-8H
InChI Key:
AUTGLFSBJLERMV-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)c1ccccc1
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Antiplatelet and antithrombotic activities of CP201, a newly synthesized 1,4-naphthoquinone derivative. | Vascular pharmacology 20040201 |
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