Isocyanates
1,1,3,3-Tetramethylbutyl isocyanate, 98%
CAS: 1611-57-0 Molecular Formula: C9H17NO Molecular Weight (g/mol): 155.24 MDL Number: MFCD00209615 InChI Key: XOHBENIMDRFUIH-UHFFFAOYSA-N PubChem CID: 407498 IUPAC Name: 2-isocyanato-2,4,4-trimethylpentane SMILES: CC(C)(C)CC(C)(C)N=C=O
(S)-(-)-1-(4-Methoxyphenyl)ethyl isocyanate, 95%
CAS: 745783-83-9 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD05664085 InChI Key: WTNKKJUXEYSETC-QMMMGPOBSA-N Synonym: s---1-4-methoxyphenyl ethyl isocyanate,1-1s-1-isocyanatoethyl-4-methoxybenzene,s-1-4-methoxyphenyl ethylisocyanate,s---1-4-methoxyphenyl ethylisocyanate,s ?-?-? ?-?1-? 4-?methoxyphenyl ?ethyl isocyanat,benzene, 1-1s-1-isocyanatoethyl-4-methoxy-9ci,s---1-3-methoxyphenyl ethyl isocyanate PubChem CID: 7018272 IUPAC Name: 1-[(1S)-1-isocyanatoethyl]-4-methoxybenzene SMILES: CC(C1=CC=C(C=C1)OC)N=C=O
Benzyl isocyanate, 98%
CAS: 3173-56-6 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00009701 InChI Key: YDNLNVZZTACNJX-UHFFFAOYSA-N Synonym: benzyl isocyanate,isocyanatomethyl benzene,benzylisocyanate,isocyanic acid benzyl ester,benzene, isocyanatomethyl,1-isocyanatomethyl benzene,phenylmethyl isocyanate,unii-8i2li357gq,phenylmethanisocyanate PubChem CID: 76639 IUPAC Name: isocyanatomethylbenzene SMILES: O=C=NCC1=CC=CC=C1
Ethyl 3-isocyanatopropionate, 98%
CAS: 5100-34-5 Molecular Formula: C6H9NO3 Molecular Weight (g/mol): 143.14 MDL Number: MFCD00078461 InChI Key: XBSGYVHOINMTIM-UHFFFAOYSA-N Synonym: ethyl 3-isocyanatopropionate,propanoic acid, 3-isocyanato-, ethyl ester,3-isocyanatopropionic acid ethyl ester,ethyl n-oxomethylidene-beta-alaninate,ethyl n-oxomethylene-beta-alaninate,acmc-20akzk,ethyl-3-isocyanatopropionate,ethyl 3-isocyanato-propionate,ethyl 3-isocyanatopropion-ate,ethyl-3-isocyanato-propionate PubChem CID: 2733373 IUPAC Name: ethyl 3-isocyanatopropanoate SMILES: CCOC(=O)CCN=C=O
4-n-Butylphenyl isocyanate, 98%
CAS: 69342-47-8 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.231 MDL Number: MFCD00013882 InChI Key: LJJRXPXDTAUVQU-UHFFFAOYSA-N Synonym: 4-butylphenyl isocyanate,4-n-butylphenyl isocyanate,benzene, 1-butyl-4-isocyanato,benzene,1-butyl-4-isocyanato,4-butylbenzenisocyanate,4-butylphenylisocyanate,acmc-209o7f,1-butyl-4-isocyanato-benzene,4-n-butyl phenyl isocyanate PubChem CID: 2796313 IUPAC Name: 1-butyl-4-isocyanatobenzene SMILES: CCCCC1=CC=C(C=C1)N=C=O
2,3-Dichlorophenyl isocyanate, 97%
CAS: 41195-90-8 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.01 MDL Number: MFCD00002000 InChI Key: FYWJWWMKCARWQG-UHFFFAOYSA-N Synonym: 2,3-dichlorophenyl isocyanate,2,3-dichlorophenylisocyanate,benzene, 1,2-dichloro-3-isocyanato,1,2-dichloro-3-isocyanato-benzene,2,3-dichlorobenzenisocyanate,benzene, dichloroisocyanato,dichlorphenylisocyanate,dichlorophenyl isocyanate,acmc-1ap4f,2,3dichlorophenylisocyanate PubChem CID: 33050 IUPAC Name: 1,2-dichloro-3-isocyanatobenzene SMILES: ClC1=CC=CC(N=C=O)=C1Cl
3-(Methoxycarbonyl)phenyl isocyanate, 97%
CAS: 41221-47-0 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.16 MDL Number: MFCD00037077 InChI Key: WBGWGERFPSYHDT-UHFFFAOYSA-N Synonym: 3-carbomethoxyphenyl isocyanate,3-isocyanatobenzoic acid methyl ester,benzoic acid, 3-isocyanato-, methyl ester,3-methoxycarbonyl phenyl isocyanate,acmc-20akh8,methyl-3-isocyanatobenzoate,3-carbomethoxyphenylisocyanate,methyl 3-isocyanatobenzoate,3-isocyanato-benzoic acid methyl ester,m-methoxycarbonylphenyl isocyanate PubChem CID: 2733366 IUPAC Name: methyl 3-isocyanatobenzoate SMILES: COC(=O)C1=CC=CC(=C1)N=C=O
4-Isocyanatobenzeneboronic acid pinacol ester, 95%
CAS: 380430-64-8 Molecular Formula: C13H16BNO3 Molecular Weight (g/mol): 245.085 MDL Number: MFCD03411942 InChI Key: RHKRIDVZGAXYQE-UHFFFAOYSA-N Synonym: 2-4-isocyanatophenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,4-isocyanatophenylboronic acid pinacol ester,1,3,2-dioxaborolane, 2-4-isocyanatophenyl-4,4,5,5-tetramethyl,4-isocyanatophenylboronic acid, pinacol ester,4-isocyanatophenyl boronic acid pinacol ester,4-isocyanatobenzeneboronic acid pinacol ester,4-isocyanatophenyl boronic acid, pinacol ester,4-isocyanatophenyl boronic acid,pinacol ester,2-4-isocyanato-phenyl-4,4,5,5-tetramethyl-1,3,2 dioxaborolane PubChem CID: 2773474 IUPAC Name: 2-(4-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N=C=O
Isophorone diisocyanate, 99.3%, For GC analysis, MP Biomedicals™
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
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
(R)-(-)-1-(1-Naphthyl)ethyl Isocyanate 90.0+%, TCI America™
CAS: 42340-98-7 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.24 MDL Number: MFCD00004015 InChI Key: GONOHGQPZFXJOJ-SNVBAGLBSA-N Synonym: r---1-1-naphthyl ethyl isocyanate,isocyanic acid r---1-1-naphthyl ethyl ester,1-1r-1-isocyanatoethyl naphthalene,naphthalene,1-1r-1-isocyanatoethyl,1r-1-naphthylethanisocyanate,1-1-isocyanatoethyl naphthalene #,pubchem8100,r-nei,r-1-1-naphthyl ethyl isocyanate PubChem CID: 170633 IUPAC Name: 1-[(1R)-1-isocyanatoethyl]naphthalene SMILES: C[C@@H](N=C=O)C1=C2C=CC=CC2=CC=C1
Heptyl Isocyanate 97.0+%, TCI America™
CAS: 4747-81-3 Molecular Formula: C8H15NO Molecular Weight (g/mol): 141.21 MDL Number: MFCD00144892 InChI Key: RFXBSYPBSRSQDU-UHFFFAOYSA-N Synonym: heptyl isocyanate,n-heptyl isocyanate,1-heptyl isocyanate,heptane, 1-isocyanato,n-heptylisocyanate,heptylisocyanate,acmc-209k9f,isocyanic acid heptyl ester,1-isocyanatoheptan-2-yl PubChem CID: 138341 IUPAC Name: 1-isocyanatoheptane SMILES: CCCCCCCN=C=O
1,3-Phenylene Diisocyanate 98.0+%, TCI America™
CAS: 123-61-5 Molecular Formula: C8H4N2O2 Molecular Weight (g/mol): 160.132 MDL Number: MFCD00002018 InChI Key: VGHSXKTVMPXHNG-UHFFFAOYSA-N Synonym: 1,3-phenylene diisocyanate,m-phenylene diisocyanate,benzene, 1,3-diisocyanato,benzene 1,3-diisocyanate,nacconate 400,benzene, m-diisocyanato,m-phenylene isocyanate,benzene-1,3-diisocyanate,isocyanic acid, m-phenylene ester,unii-b44h9mfh1s PubChem CID: 31262 IUPAC Name: 1,3-diisocyanatobenzene SMILES: C1=CC(=CC(=C1)N=C=O)N=C=O
Cyclopentyl Isocyanate 98.0+%, TCI America™
CAS: 4747-71-1 Molecular Formula: C6H9NO Molecular Weight (g/mol): 111.144 MDL Number: MFCD02093695 InChI Key: CZALJDQHONFVFU-UHFFFAOYSA-N Synonym: cyclopentyl isocyanate,cyclopentylisocyanate,cyclopentane, isocyanato,isocyanic acid cyclopentyl ester,isocyanato cyclopentane,isocyanato-cyclopentane,acmc-1aspa,ksc497s6f PubChem CID: 643500 IUPAC Name: isocyanatocyclopentane SMILES: C1CCC(C1)N=C=O
1-Adamantyl Isocyanate 98.0+%, TCI America™
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