C1=CC=C(C=C1)C2=CC(=NC=N2)Cl
CAS: 3435-26-5
Name: 4-chloro-6-phenylpyrimidine
SMILES: C1=CC=C(C=C1)C2=CC(=NC=N2)Cl

Molecular Processing

Molecular formula
C10H7ClN2
Molecular weight
190.63
Exact mass
190.0298
XLogP
2.8
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
52.48

Supplementary Information

InChIKey: RHTJKTOWBBKGNJ-UHFFFAOYSA-N
Synonyme
4-Chloro-6-phenylpyrimidine3435-26-5Pyrimidine, 4-chloro-6-phenyl-DTXSID10343950RefChem:98498DTXCID10295026808-692-3RHTJKTOWBBKGNJ-UHFFFAOYSA-NMFCD002346044-chloro-6-phenyl-pyrimidineSCHEMBL632053SCHEMBL28474967SCHEMBL29392239DAA43526SBB054540AKOS002672882SB57508SDCCGSBI-0660094.P001SY152244DB-332244CS-0045908VU0608722-1D82880EN300-133703AC-907/25004991F067461F3284-7953Z800200798
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