C1=C(C(=C(C(=C1F)N)Br)F)C=O
CAS: 112279-63-7
Name: 4-amino-3-bromo-2,5-difluorobenzaldehyde
SMILES: C1=C(C(=C(C(=C1F)N)Br)F)C=O

Molecular Processing

Molecular formula
C7H4BrF2NO
Molecular weight
236.01
Exact mass
234.9444
XLogP
2.12
TPSA
43.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
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
43.86

Supplementary Information

InChIKey: OGOLSJPCDPNAAR-UHFFFAOYSA-N
Synonyme
4-amino-3-bromo-2,5-difluorobenzaldehyde112279-63-7SCHEMBL332671OGOLSJPCDPNAAR-UHFFFAOYSA-NDTXSID001277408DA-154184-amino-3-bromo-2,5-difluoro-benzaldehyde
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