C1=C(C(=NC(=N1)Cl)Cl)F
CAS: 2927-71-1
Name: 2,4-dichloro-5-fluoropyrimidine
SMILES: C1=C(C(=NC(=N1)Cl)Cl)F

Molecular Processing

Molecular formula
C4HCl2FN2
Molecular weight
166.97
Exact mass
165.9501
XLogP
1.92
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
32.01

Supplementary Information

InChIKey: WHPFEQUEHBULBW-UHFFFAOYSA-N
Synonyms
2,4-Dichloro-5-fluoropyrimidine2927-71-1DTXSID00290702RefChem:82334DTXCID30241848625-810-7WHPFEQUEHBULBW-UHFFFAOYSA-N5-fluoro-2,4-dichloropyrimidinePYRIMIDINE, 2,4-DICHLORO-5-FLUORO-2,4-dichloro-5-fluoro-pyrimidineMFCD002335512,4-dichloro-5-fluoro pyrimidineNSC-704422,6-DICHLORO-5-FLUOROPYRIMIDINENSC704422 pound not4-Dichloro-5-fluoropyrimidineBLQ52TC9PWNCIOpen2_000539SCHEMBL1906572,4-dichloro-5fluoropyrimidine2,4dichloro-5-fluoropyrimidineSCHEMBL53424362,4-Dichloro-5-fluoropyrmidineSCHEMBL293916635-fluoro-2,6-dichloropyrimidine5-fluoro-2,4-dichloro-pyrimidineALBB-014452EBC-77067NSC 70442SBB054476
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