3-Cyanophenyl isocyanate 97 %

cas: 16413-26-6 — see every product listed under this CAS number, including other names

3-Cyanophenyl isocyanate 97 % (CAS 16413-26-6) is a chemical reagent available from Chemat. Available pack sizes: 5G. Offered by: Sigma-Aldrich.

brandSigma-Aldrich
catalog number439991-5G
cas16413-26-6
size5G
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Sigma-Aldrich 5G 587.00 Pln
Structural formula: {0} (CAS {1})

3-isocyanatobenzonitrile (CAS 16413-26-6) is a chemical compound with the molecular formula C8H4N2O and a molecular weight of 144.13 g/mol. IUPAC name: 3-isocyanatobenzonitrile. InChIKey: NZHPVPMRNASEQK-UHFFFAOYSA-N.

Identity
Molecular formulaC8H4N2O
Molecular weight144.13 g/mol
IUPAC name3-isocyanatobenzonitrile
InChIKeyNZHPVPMRNASEQK-UHFFFAOYSA-N
SMILESC1=CC(=CC(=C1)N=C=O)C#N

Computed by PubChem (NCBI)

Synonyms: 3-isocyanatobenzonitrile, 3-Cyanophenyl isocyanate, 3-Cyanophenylisocyanate, Benzonitrile, 3-isocyanato-, M-CYANOPHENYL ISOCYANATE, 3-isocyanatobenzenecarbonitrile, m-cyanophenylisocyanate, 3-isocyanato-benzonitrile, 4-hydroxy-isophthalonitrile, 3-Cyanophenylisocyanate 97%
Isomers (same molecular formula)
1,3-benzoxazole-5-carbonitrile C8H4N2O
furo[3,2-b]pyridine-6-carbonitrile C8H4N2O
1,3-benzoxazole-2-carbonitrile C8H4N2O
4-hydroxybenzene-1,2-dicarbonitrile C8H4N2O
4-hydroxybenzene-1,3-dicarbonitrile C8H4N2O
furo[3,2-c]pyridine-4-carbonitrile C8H4N2O
4-isocyanatobenzonitrile C8H4N2O
2-(furan-2-ylmethylidene)propanedinitrile C8H4N2O
5-hydroxybenzene-1,3-dicarbonitrile C8H4N2O
furo[3,2-b]pyridine-7-carbonitrile C8H4N2O
3-hydroxybenzene-1,2-dicarbonitrile C8H4N2O
2-hydroxybenzene-1,3-dicarbonitrile C8H4N2O

Also listed as

3–Cyanophenyl isocyanate GLPBio CAS 16413-26-6
3-Cyanophenyl isocyanate, 97% Thermo Scientific (Alfa Aesar) CAS 16413-26-6
3-Cyanophenylisocyanate, 98% Ambeed CAS 16413-26-6
3-Cyanophenyl isocyanate, 98% 3-Cyanophenyl isocyanate, 98% Fluorochem CAS 16413-26-6

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