C1=CC=C2C(=C1)C=CC=C2N=C=O
CAS: 86-84-0
Name: 1-isocyanatonaphthalene
SMILES: C1=CC=C2C(=C1)C=CC=C2N=C=O

Molecular Processing

Molecular formula
C11H7NO
Molecular weight
169.18
Exact mass
169.0528
XLogP
2.81
TPSA
29.43
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
51.73

Supplementary Information

InChIKey: BDQNKCYCTYYMAA-UHFFFAOYSA-N
Synonyme
1-Naphthyl isocyanate86-84-01-Isocyanatonaphthalene1-NaphthylisocyanateNaphthalene, 1-isocyanato-alpha-Naphthyl isocyanateNaphthalene, isocyanato-Isocyanic Acid 1-Naphthyl EsterIsocyanic acid, 1-naphthyl ester.alpha.-Naphthyl isocyanateDTXSID90589495LH2P0691ENSC 4023NSC-4023EINECS 201-703-7AI3-15382NAPHTHYL ISOCYANATE, 1-1-NAPHTHYLISOCYANATE [MI]EC 201-703-71IsocyanatonaphthalenealphaNaphthyl isocyanateNaphthalene, 1isocyanatoRefChem:555894Isocyanic acid, 1naphthyl esterDTXCID4048515Isocyanic acid, 1naphthyl ester (8CI)Isocyanic acid, 1-naphthyl ester (8CI)201-703-7610-028-030135-65-0
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