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Home > Aldehydes > 876710-73-5
876710-73-5 | 2-(2-METHYLPHENYL)PYRIMIDINE-5-CARBALDEHYDE
CAS No: 876710-73-5 Catalog No: AG004H6C MDL No:MFCD07643179
Product Description
Catalog Number:
AG004H6C
Chemical Name:
2-(2-METHYLPHENYL)PYRIMIDINE-5-CARBALDEHYDE
CAS Number:
876710-73-5
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
MDL Number:
MFCD07643179
IUPAC Name:
2-(2-methylphenyl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C12H10N2O/c1-9-4-2-3-5-11(9)12-13-6-10(8-15)7-14-12/h2-8H,1H3
InChI Key:
YEDAXYCLTUUWOY-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)c1ccccc1C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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