C1=CN=CC(=C1Cl)Br
CAS: 36953-42-1
Nom: 3-bromo-4-chloropyridine
SMILES: C1=CN=CC(=C1Cl)Br

Molecular Processing

Molecular formula
C5H3BrClN
Molecular weight
192.44
Exact mass
190.9137
XLogP
2.5
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
1
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
36.95

Supplementary Information

InChIKey: QADXKWUCCGPQNR-UHFFFAOYSA-N
Synonymes
3-bromo-4-chloropyridine36953-42-1DTXSID00958133RefChem:498621DTXCID501386050690-646-53-Bromo-4-chloro-pyridineMFCD002340081812569-18-8PYRIDINE, 3-BROMO-4-CHLORO-4-CHLORO-3-BROMOPYRIDINESCHEMBL360577SCHEMBL3432939SCHEMBL5468074SCHEMBL18938725SCHEMBL29571714QADXKWUCCGPQNR-UHFFFAOYSA-NCS-M3246AC-160SBB0542493-Bromo-4-chloropyridine, AldrichCPRAKOS005255034AB05074PS-4256DB-022331EN300-116572AC-907/34115034F067260F0001-4074
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Recherche Etendue

Recherche de Sous-structure→Recherche de Similitude→