CC1=NC=NC=C1
CAS: 3438-46-8
Nombre: 4-methylpyrimidine
SMILES: CC1=NC=NC=C1

Molecular Processing

Molecular formula
C5H6N2
Molecular weight
94.12
Exact mass
94.0531
XLogP
0.79
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
26.77

Supplementary Information

InChIKey: LVILGAOSPDLNRM-UHFFFAOYSA-N
Sinónimos
4-METHYLPYRIMIDINE3438-46-8Pyrimidine, 4-methyl-4-methyl-pyrimidineMFCD000061153D1R4OMX4NEINECS 222-344-24-Methylpyrimidine, 97%UNII-3D1R4OMX4NSCHEMBL12441SCHEMBL127453SCHEMBL205815SCHEMBL352893SCHEMBL413067orb3023390SCHEMBL2906033SCHEMBL9903148DTXSID5063027SCHEMBL11016162SCHEMBL29597429CS-M0723TN9633AKOS005146203FM08917PB17038BP-20350SY009308DB-003971M0356NS00014403
Ver fuente →
Participa en 42 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→