C1=CC(=C(C(=C1)Cl)C(=O)N=C=O)Cl
CAS: 35377-49-2
Name: 2,6-dichlorobenzoyl isocyanate
SMILES: C1=CC(=C(C(=C1)Cl)C(=O)N=C=O)Cl

Molecular Processing

Molecular formula
C8H3Cl2NO2
Molecular weight
216.02
Exact mass
214.9541
XLogP
2.47
TPSA
46.5
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
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
48.91

Supplementary Information

InChIKey: JHKYTLZWWVOYCP-UHFFFAOYSA-N
Synonyme
2,6-dichlorobenzoyl isocyanate35377-49-22,6-dichlorobenzoylisocyanate2,6-dichloro-benzoylisocyanateSCHEMBL7754721DTXSID30512782JHKYTLZWWVOYCP-UHFFFAOYSA-N
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