CCC1=CN=C(N=C1Cl)Cl
CAS: 34171-40-9
名称: 2,4-dichloro-5-ethylpyrimidine
SMILES: CCC1=CN=C(N=C1Cl)Cl

Molecular Processing

Molecular formula
C6H6Cl2N2
Molecular weight
177.03
Exact mass
175.9908
XLogP
2.35
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
41.43

Supplementary Information

InChIKey: YFYFVWTWMBQHOH-UHFFFAOYSA-N
同義語
2,4-dichloro-5-ethylpyrimidine34171-40-9DTXSID50434093RefChem:246229DTXCID703849202,4-dichloro-5-ethyl-pyrimidineMFCD11040247Pyrimidine, 2,4-dichloro-5-ethyl-ethyl 2,4-dichloropyrimidineSCHEMBL4579208SCHEMBL23457248SCHEMBL27809349SCHEMBL30238970WLZ5115YFYFVWTWMBQHOH-UHFFFAOYSA-NAKOS006308061CS-W005213SB57703AS-19651SY037670EN300-6745883F222483Z1198305337
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