Isocyanates
4-(Trifluoromethoxy)phenyl isocyanate, 97%, Thermo Scientific™
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
3-(Ethoxycarbonyl)phenyl isocyanate, 97%
CAS: 67531-68-4 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.19 MDL Number: MFCD00013865 InChI Key: UPXGGIRFDZENRD-UHFFFAOYSA-N Synonym: 3-ethoxycarbonyl phenyl isocyanate,3-carbethoxyphenyl isocyanate,3-ethoxycarbonylphenyl isocyanate,3-ethoxycarbonyl phenylisocyanate,3-isocyanatobenzoic acid ethyl ester,3-carboethoxyphenyl isocyanate,#,ethyl 3-isocyanatobenzoate,3-ethoxycarbonyl phenylisothiocyanate,3-isocyanato-benzoic acid ethyl ester PubChem CID: 589806 IUPAC Name: ethyl 3-isocyanatobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)N=C=O
2,4-Dichlorophenyl isocyanate, 96%
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
Benzoyl isocyanate, 90%, Tech.
CAS: 4461-33-0 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.13 MDL Number: MFCD00002032 InChI Key: LURYMYITPCOQAU-UHFFFAOYSA-N Synonym: benzoylisocyanate,methanone, 1-phenyl-1-isocyanato,oxophenylmethanisocyanate,benzoyl isocynate,phconco,acmc-20alpt,pubchem7575,isocyanato phenyl methanone,isocyanato-phenyl-methanone,9ci PubChem CID: 78210 IUPAC Name: benzoyl isocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=O
Pentyl isocyanate, 98%
CAS: 3954-13-0 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00144846 InChI Key: VRVUKQWNRPNACD-UHFFFAOYSA-N Synonym: pentyl isocyanate,pentylisocyanate,pentane, 1-isocyanato,1-pentyl isocyanate,n-pentyl isocyanate,1-isocyanato-pentane,amylisocyanat,n-pentylisocyanate,n-amyl isocyanate,acmc-1clhg PubChem CID: 206036 IUPAC Name: 1-isocyanatopentane SMILES: CCCCCN=C=O
Phenyl isocyanate, ≥99.0% (GC), MilliporeSigma™ Supelco™
MDL Number: MFCD00001994
1-Adamantyl isocyanate, 98%
CAS: 4411-25-0 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.25 MDL Number: MFCD00134405 InChI Key: VBHCPGFCIQDXGZ-UHFFFAOYSA-N Synonym: 1-adamantyl isocyanate,1-isocyanato-adamantane,1-isocyantoadamantane,1-adamantylisocyanate,adamantanisocyanate,adamantyl isocyanate,pubchem8848,1-adamantyl-isocyanate,1-adamantanyl isocyanate,adamantane, 1-isocyanato PubChem CID: 2059995 IUPAC Name: 1-isocyanatoadamantane SMILES: O=C=NC12CC3CC(CC(C3)C1)C2
Octyl isocyanate, 99%
CAS: 3158-26-7 Molecular Formula: C9H17NO Molecular Weight (g/mol): 155.24 MDL Number: MFCD00013887 InChI Key: DYQFCTCUULUMTQ-UHFFFAOYSA-N Synonym: octyl isocyanate,octylisocyanate,octane, 1-isocyanato,n-octylisocyanate,1-octyl isocyanate,n-octyl isocyanate,1-isocyanato-octane,isocyanic acid, octyl ester,octanisocyanate PubChem CID: 76616 IUPAC Name: 1-isocyanatooctane SMILES: CCCCCCCCN=C=O
4-Ethoxyphenyl isocyanate, 97%
CAS: 32459-62-4 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00013877 InChI Key: FMYVTFRADSNGDN-UHFFFAOYSA-N Synonym: 4-ethoxyphenyl isocyanate,benzene, 1-ethoxy-4-isocyanato,4-ethoxyphenylisocyanate,4-isocyanatophenetole,isocyanic acid 4-ethoxyphenyl ester,p-ethoxy phenyl isocyanate,4-ethoxybenzenisocyanate,pubchem3178,p-athoxyphenylisocyanat,acmc-1afep PubChem CID: 122887 IUPAC Name: 1-ethoxy-4-isocyanatobenzene SMILES: CCOC1=CC=C(C=C1)N=C=O
(S)-(-)-alpha-Methylbenzyl isocyanate, 98%
CAS: 14649-03-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 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
4-Cyanophenyl isocyanate, 95%, Thermo Scientific Chemicals
CAS: 40465-45-0 Molecular Formula: C8H4N2O Molecular Weight (g/mol): 144.13 MDL Number: MFCD00037038 InChI Key: TVSXDZNUTPLDKY-UHFFFAOYSA-N PubChem CID: 170380 IUPAC Name: 4-isocyanatobenzonitrile SMILES: C1=CC(=CC=C1C#N)N=C=O
3,4-Dichlorophenyl isocyanate, 97%
CAS: 102-36-3 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.007 MDL Number: MFCD00002017 InChI Key: MFUVCHZWGSJKEQ-UHFFFAOYSA-N Synonym: 3,4-dichlorophenyl isocyanate,benzene, 1,2-dichloro-4-isocyanato,3,4-dichlorfenylisokyanat,isocyanic acid 3,4-dichlorophenyl ester,3,4-dichlorophenylisocyanate,unii-ozw0b7f1du,3,4-dichlorphenylisocyanate,isocyanic acid, 3,4-dichlorophenyl ester,3,4-dichlorfenylisokyanat czech,ozw0b7f1du PubChem CID: 7607 IUPAC Name: 1,2-dichloro-4-isocyanatobenzene SMILES: C1=CC(=C(C=C1N=C=O)Cl)Cl
4,4'-Methylenebis(cyclohexyl isocyanate), 90%, mixture of isomers, AcroSeal™
CAS: 5124-30-1 Molecular Formula: C15H22N2O2 Molecular Weight (g/mol): 262.35 MDL Number: MFCD00015405 InChI Key: KORSJDCBLAPZEQ-UHFFFAOYSA-N Synonym: hydrogenated mdi,hylene w,bis 4-isocyanatocyclohexyl methane,4,4'-diisocyanatodicyclohexylmethane,methylene bis 4-cyclohexylisocyanate,dicyclohexylmethane 4,4'-diisocyanate,dicyclohexylmethane-4,4'-diisocyanate,methylene bis-4-cyclohexylisocyanate,nacconate h 12,cyclohexane, 1,1'-methylenebis 4-isocyanato PubChem CID: 21202 ChEBI: CHEBI:53216 IUPAC Name: 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane SMILES: O=C=NC1CCC(CC2CCC(CC2)N=C=O)CC1
Isophorone diisocyanate, 98+%, mixture of isomers
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
2,6-Dichlorophenyl isocyanate, 98%
CAS: 39920-37-1 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.007 MDL Number: MFCD00002003 InChI Key: HMVKMAMIRAVXAN-UHFFFAOYSA-N Synonym: 2,6-dichlorophenyl isocyanate,benzene, 1,3-dichloro-2-isocyanato,2,6-dichlorophenylisocyanate,isocyanic acid 2,6-dichlorophenyl ester,pubchem23916,acmc-1ailv,2,6 dichlorophenylisocyanate,2,6-dichlorobenzenisocyanate,2,6dichlorophenyl isocyanate,1,3-dichloro-2-isocyanato-benzene PubChem CID: 604537 IUPAC Name: 1,3-dichloro-2-isocyanatobenzene SMILES: C1=CC(=C(C(=C1)Cl)N=C=O)Cl