Isocyanates
1,5-Diisocyanatonaphthalene 98.0+%, TCI America™
CAS: 3173-72-6 Molecular Formula: C12H6N2O2 Molecular Weight (g/mol): 210.192 InChI Key: SBJCUZQNHOLYMD-UHFFFAOYSA-N Synonym: Naphthalene 1,5-Diisocyanate PubChem CID: 18503 ChEBI: CHEBI:82496 IUPAC Name: 1,5-diisocyanatonaphthalene SMILES: C1=CC2=C(C=CC=C2N=C=O)C(=C1)N=C=O
3,5-Dichlorophenyl Isocyanate 97.0+%, TCI America™
CAS: 34893-92-0 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.007 MDL Number: MFCD00013859 InChI Key: XEFUJGURFLOFAN-UHFFFAOYSA-N Synonym: 3,5-dichlorophenyl isocyanate,3,5-dichlorophenylisocyanate,benzene, 1,3-dichloro-5-isocyanato,3,5-dichlorophenyl isocyantae,1,3-dichloro-5-isocyanato-benzene,3,5-dichlorobenzenisocyanate,3,5dichlorophenyl isocyanate,acmc-1ai47,ksc490c1l,3,5-dichloro-phenylisocyanate PubChem CID: 94460 IUPAC Name: 1,3-dichloro-5-isocyanatobenzene SMILES: C1=C(C=C(C=C1Cl)Cl)N=C=O
4-(Trifluoromethoxy)phenyl Isocyanate 98.0+%, TCI America™
CAS: 35037-73-1 Molecular Formula: C8H4F3NO2 Molecular Weight (g/mol): 203.12 MDL Number: MFCD00035702 InChI Key: LGPKFIGMLPDYEA-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy phenyl isocyanate,1-isocyanato-4-trifluoromethoxy benzene,4-trifluoromethoxy phenylisocyanate,4-trifluoromethoxyphenylisocyanate,benzene, 1-isocyanato-4-trifluoromethoxy,1-isocyanato-4-trifluoromethoxy-benzene,p-trifluoromethoxy phenyl isocyanate,isocyanic acid 4-trifluoromethoxy phenyl ester,4-trifluoromethoxy benzenisocyanate PubChem CID: 92298 IUPAC Name: 1-isocyanato-4-(trifluoromethoxy)benzene SMILES: C1=CC(=CC=C1N=C=O)OC(F)(F)F
1-Naphthyl Isocyanate 99.0+%, TCI America™
CAS: 86-84-0 Molecular Formula: C11H7NO Molecular Weight (g/mol): 169.183 MDL Number: MFCD00003881 InChI Key: BDQNKCYCTYYMAA-UHFFFAOYSA-N Synonym: 1-naphthyl isocyanate,naphthalene, 1-isocyanato,alpha-naphthyl isocyanate,isocyanatonaphthalene,1-naphthylisocyanate,1-isocyanato-naphthalene,unii-5lh2p0691e,1-isocyanatonapthalene,isocyanic acid 1-naphthyl ester,isocyanic acid, 1-naphthyl ester PubChem CID: 66589 IUPAC Name: 1-isocyanatonaphthalene SMILES: C1=CC=C2C(=C1)C=CC=C2N=C=O
2,4-Dichlorophenyl Isocyanate 98.0+%, TCI America™
CAS: 2612-57-9 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.007 MDL Number: MFCD00002001 InChI Key: OLBJNSPBWLCTOT-UHFFFAOYSA-N Synonym: 2,4-dichlorophenyl isocyanate,2,4-dichlorophenylisocyanate,benzene, 2,4-dichloro-1-isocyanato,2,4-dichlorophenyl isocyantae,2,4-dichlorobenzenisocyanate,acmc-1cg9n,2,4-dichlorphenyl isocyanate,2,4-dichloro phenyl isocyanate,# PubChem CID: 75789 IUPAC Name: 2,4-dichloro-1-isocyanatobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)N=C=O
Isophorone Diisocyanate (mixture of isomers) 99.0+%, TCI America™
CAS: 4098-71-9 Molecular Formula: C12H18N2O2 Molecular Weight (g/mol): 222.29 MDL Number: MFCD00064956 InChI Key: NIMLQBUJDJZYEJ-UHFFFAOYNA-N Synonym: isophorone diisocyanate,ipdi,isophorone diamine diisocyanate,5-isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane,3-isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate,cyclohexane, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethyl,3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate,ccris 6252,isocyanic acid, methylene 3,5,5-trimethyl-3,1-cyclohexylene ester,isophorone diisocyanate diisocyanates PubChem CID: 169132 ChEBI: CHEBI:53214 IUPAC Name: 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane SMILES: CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O
4-Nitrophenyl Isocyanate (contains varying amounts of polymers) 98.0+%, TCI America™
CAS: 100-28-7 Molecular Formula: C7H4N2O3 Molecular Weight (g/mol): 164.12 MDL Number: MFCD00007306 InChI Key: GFNKTLQTQSALEJ-UHFFFAOYSA-N Synonym: 4-nitrophenyl isocyanate,p-nitrophenyl isocyanate,benzene, 1-isocyanato-4-nitro,4-nitrophenylisocyanate,p-nitrophenylisocyanate,isocyanic acid, p-nitrophenyl ester,1-isocyanato-4-nitro-benzene,isocyanic acid 4-nitrophenyl ester,timtec-bb sbb006628,4-nitrobenzenisocyanate PubChem CID: 66012 IUPAC Name: 1-isocyanato-4-nitrobenzene SMILES: C1=CC(=CC=C1N=C=O)[N+](=O)[O-]
(S)-(-)-alpha-Methylbenzyl Isocyanate 98.0+%, TCI America™
CAS: 14649-03-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00002036 InChI Key: JJSCUXAFAJEQGB-QMMMGPOBSA-N Synonym: s---1-phenylethyl isocyanate,1s-1-isocyanatoethyl benzene,s---alpha-methylbenzyl isocyanate,benzene, 1s-1-isocyanatoethyl,isocyanic acid s---a-methylbenzyl ester,s-alpha-methylbenzyl isocyanate,s---1-phenylethylisocyanate,isocyanic acid s---alpha-methylbenzyl ester,isocyanic acid s---methylbenzyl ester,1-isocyanatoethyl benzene # PubChem CID: 2724173 IUPAC Name: [(1S)-1-isocyanatoethyl]benzene SMILES: CC(C1=CC=CC=C1)N=C=O
Phenethyl Isocyanate 98.0+%, TCI America™
CAS: 1943-82-4 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00037044 InChI Key: HACRKYQRZABURO-UHFFFAOYSA-N Synonym: phenethyl isocyanate,2-isocyanatoethyl benzene,phenylethyl isocyanate,2-phenylethyl isocyanate,2-phenylethylisocyanate,phenylethylisocyanate,phenethylisocyanate,benzene, 2-isocyanatoethyl,2-isocyanato-ethyl-benzene,2-phenethyl isocyanate PubChem CID: 160602 ChEBI: CHEBI:60067 IUPAC Name: 2-isocyanatoethylbenzene SMILES: C1=CC=C(C=C1)CCN=C=O
Trichloroacetyl Isocyanate 97.0+%, TCI America™
CAS: 3019-71-4 Molecular Formula: C3Cl3NO2 Molecular Weight (g/mol): 188.39 MDL Number: MFCD00002033 InChI Key: GRNOZCCBOFGDCL-UHFFFAOYSA-N Synonym: trichloroacetyl isocyanate,acetyl isocyanate, trichloro,trichloroacetylisocyanate,isocyanic acid trichloroacetyl ester,unii-qxv1p5j6jl,qxv1p5j6jl,acetyl isocyanate, 2,2,2-trichloro,2,2,2-trichloroethanecarbonyl isocyanate,trichloroethanecarbonyl isocyanate,trichloroacetyl isocyanate, nmr grade PubChem CID: 76400 IUPAC Name: trichloroethanecarbonyl isocyanate SMILES: ClC(Cl)(Cl)C(=O)N=C=O
Hexamethylene Diisocyanate 98.0+%, TCI America™
CAS: 822-06-0 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.20 MDL Number: MFCD00002047 InChI Key: RRAMGCGOFNQTLD-UHFFFAOYSA-N Synonym: hexamethylene diisocyanate,1,6-hexamethylene diisocyanate,hmdi,hexane, 1,6-diisocyanato,hexane 1,6-diisocyanate,1,6-hexylene diisocyanate,hexamethylene-1,6-diisocyanate,1,6-hexanediol diisocyanate,hdi,isocyanic acid, hexamethylene ester PubChem CID: 13192 ChEBI: CHEBI:53578 IUPAC Name: 1,6-diisocyanatohexane SMILES: O=C=NCCCCCCN=C=O
4-Chloro-3-nitrophenyl Isocyanate 95.0+%, TCI America™
CAS: 40397-96-4 Molecular Formula: C7H3ClN2O3 Molecular Weight (g/mol): 198.56 MDL Number: MFCD00037062 InChI Key: ZCPHLSPLEGBTCZ-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrophenyl isocyanate,4-chloro-3-nitrophenylisocyanate,3-nitro-4-chlorophenyl isocyanate,4-chloro-3-nitrobenzenisocyanate,acmc-209jdv,#,benzene,1-chloro-4-isocyanato-2-nitro,1-chloranyl-4-isocyanato-2-nitro-benzene,isocyanic acid 4-chloro-3-nitrophenyl ester PubChem CID: 142448 IUPAC Name: 1-chloro-4-isocyanato-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC(=CC=C1Cl)N=C=O
4-Ethylphenyl Isocyanate 97.0+%, TCI America™
CAS: 23138-50-3 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00013881 InChI Key: FWPYUSLQCQDLJR-UHFFFAOYSA-N Synonym: 4-ethylphenyl isocyanate,p-ethylphenyl isocyanate,4-ethylphenylisocyanate,benzene, 1-ethyl-4-isocyanato,benzene,1-ethyl-4-isocyanato,4-ethylbenzenisocyanate,acmc-1cpzx,4-ethyl phenylisocyanate,4-ethyl-phenyl-isocyanate,1-ethyl-4-isocyanato-benzene PubChem CID: 90007 IUPAC Name: 1-ethyl-4-isocyanatobenzene SMILES: CCC1=CC=C(C=C1)N=C=O
(R)-(+)-alpha-Methylbenzyl Isocyanate 98.0+%, TCI America™
CAS: 33375-06-3 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00063015 InChI Key: JJSCUXAFAJEQGB-MRVPVSSYSA-N Synonym: r-+-1-phenylethyl isocyanate,1r-1-isocyanatoethyl benzene,r-+-alpha-methylbenzyl isocyanate,benzene, 1r-1-isocyanatoethyl,isocyanic acid r-+-1-phenylethyl ester,isocyanic acid r-+-alpha-methylbenzyl ester,isocyanic acid-r-+-methylbenzyl ester,1-isocyanatoethyl benzene #,+-alpha-methylbenzyl isocyanate,pubchem8096 PubChem CID: 7018262 IUPAC Name: [(1R)-1-isocyanatoethyl]benzene SMILES: CC(C1=CC=CC=C1)N=C=O
2-Biphenyl Isocyanate 98.0+%, TCI America™
CAS: 17337-13-2 Molecular Formula: C13H9NO Molecular Weight (g/mol): 195.22 MDL Number: MFCD00037087 InChI Key: IHHUGFJSEJSCGE-UHFFFAOYSA-N Synonym: 2-biphenylyl isocyanate,2-biphenylisocyanate,2-biphenyl isocyanate,2-isocyanatobiphenyl,2-isocyanato-biphenyl,2-biphenylylisocyanate,isocyanic acid 2-biphenyl ester,1,1'-biphenyl, isocyanato,1-isocyanato-2-phenyl-menzene,1,1-biphenyl-2-yl isocyanate PubChem CID: 222280 IUPAC Name: 2-isocyanato-1,1'-biphenyl SMILES: O=C=NC1=CC=CC=C1C1=CC=CC=C1