C1=C(C=C(C2=C1C=NN2)C=O)Cl
CAS: 1100213-27-1
名称: 5-chloro-1H-indazole-7-carbaldehyde
SMILES: C1=C(C=C(C2=C1C=NN2)C=O)Cl

Molecular Processing

Molecular formula
C8H5ClN2O
Molecular weight
180.59
Exact mass
180.009
XLogP
2.03
TPSA
45.75
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
46.49

Supplementary Information

InChIKey: COBMRCLCKOANIR-UHFFFAOYSA-N
同義語
5-chloro-1H-indazole-7-carbaldehyde1100213-27-1SCHEMBL2424804COBMRCLCKOANIR-UHFFFAOYSA-N
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