CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)N=[N+]=[N-])Cl
名称: 4-acetamido-5-chloro-2-methoxybenzoyl azide
SMILES: CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)N=[N+]=[N-])Cl

Molecular Processing

Molecular formula
C10H9ClN4O3
Molecular weight
268.66
Exact mass
268.0363
XLogP
2.76
TPSA
104.16
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
65.78

Supplementary Information

InChIKey: FNIOHKVYTWOWKM-UHFFFAOYSA-N
同義語
FNIOHKVYTWOWKM-UHFFFAOYSA-N4-acetylamino-5-chloro-2-methoxy-benzoyl azide
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