
Isocyanates
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4,4'-Methylenebis(cyclohexyl isocyanate), 90%, mixture of isomers, AcroSealâ„¢
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
PubChem CID | 21202 |
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CAS | 5124-30-1 |
Molecular Weight (g/mol) | 262.35 |
ChEBI | CHEBI:53216 |
MDL Number | MFCD00015405 |
SMILES | O=C=NC1CCC(CC2CCC(CC2)N=C=O)CC1 |
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 |
IUPAC Name | 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane |
InChI Key | KORSJDCBLAPZEQ-UHFFFAOYSA-N |
Molecular Formula | C15H22N2O2 |
Hexyl isocyanate, 99%
CAS: 2525-62-4 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.19 MDL Number: MFCD00037047 InChI Key: ANJPRQPHZGHVQB-UHFFFAOYSA-N Synonym: hexyl isocyanate,hexane, 1-isocyanato,1-hexyl isocyanate,hexylmonoisocyanate,hexyl monoisocyanate,hexylisocyanate,n-hexyl isocyanate,hexanisocyanate,isocyanatohexane,isocyanato-hexane PubChem CID: 75659 ChEBI: CHEBI:59058 IUPAC Name: 1-isocyanatohexane SMILES: CCCCCCN=C=O
PubChem CID | 75659 |
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CAS | 2525-62-4 |
Molecular Weight (g/mol) | 127.19 |
ChEBI | CHEBI:59058 |
MDL Number | MFCD00037047 |
SMILES | CCCCCCN=C=O |
Synonym | hexyl isocyanate,hexane, 1-isocyanato,1-hexyl isocyanate,hexylmonoisocyanate,hexyl monoisocyanate,hexylisocyanate,n-hexyl isocyanate,hexanisocyanate,isocyanatohexane,isocyanato-hexane |
IUPAC Name | 1-isocyanatohexane |
InChI Key | ANJPRQPHZGHVQB-UHFFFAOYSA-N |
Molecular Formula | C7H13NO |
MDL Number | MFCD00001994 |
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(S)-(-)-α-Methylbenzyl isocyanate, ≥99.0% (sum of enantiomers, GC), MilliporeSigma™ Supelco™
MDL Number: MFCD00002036 Synonym: (S)-(-)-1-Phenylethyl isocyanate
MDL Number | MFCD00002036 |
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Synonym | (S)-(-)-1-Phenylethyl isocyanate |
(R)-(+)-α-Methylbenzyl isocyanate, ≥99.0% (sum of enantiomers, GC), MilliporeSigma™ Supelco™
MDL Number: MFCD00063015 Synonym: (R)-(+)-1-Phenylethyl isocyanate
MDL Number | MFCD00063015 |
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Synonym | (R)-(+)-1-Phenylethyl isocyanate |
Allyl isocyanate, 96%
CAS: 1476-23-9 Molecular Formula: C4H5NO Molecular Weight (g/mol): 83.09 MDL Number: MFCD00002044 InChI Key: HXBPYFMVGFDZFT-UHFFFAOYSA-N PubChem CID: 15123 IUPAC Name: 3-isocyanatoprop-1-ene SMILES: C=CCN=C=O
PubChem CID | 15123 |
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CAS | 1476-23-9 |
Molecular Weight (g/mol) | 83.09 |
MDL Number | MFCD00002044 |
SMILES | C=CCN=C=O |
IUPAC Name | 3-isocyanatoprop-1-ene |
InChI Key | HXBPYFMVGFDZFT-UHFFFAOYSA-N |
Molecular Formula | C4H5NO |
1-Octyl isocyanate, 97%, Thermo Scientific Chemicals
CAS: 3158-26-7 Molecular Formula: C9H17NO Molecular Weight (g/mol): 155.241 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
PubChem CID | 76616 |
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CAS | 3158-26-7 |
Molecular Weight (g/mol) | 155.241 |
MDL Number | MFCD00013887 |
SMILES | CCCCCCCCN=C=O |
Synonym | octyl isocyanate,octylisocyanate,octane, 1-isocyanato,n-octylisocyanate,1-octyl isocyanate,n-octyl isocyanate,1-isocyanato-octane,isocyanic acid, octyl ester,octanisocyanate |
IUPAC Name | 1-isocyanatooctane |
InChI Key | DYQFCTCUULUMTQ-UHFFFAOYSA-N |
Molecular Formula | C9H17NO |
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
PubChem CID | 2733366 |
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CAS | 41221-47-0 |
Molecular Weight (g/mol) | 177.16 |
MDL Number | MFCD00037077 |
SMILES | COC(=O)C1=CC=CC(=C1)N=C=O |
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 |
IUPAC Name | methyl 3-isocyanatobenzoate |
InChI Key | WBGWGERFPSYHDT-UHFFFAOYSA-N |
Molecular Formula | C9H7NO3 |
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
PubChem CID | 407498 |
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CAS | 1611-57-0 |
Molecular Weight (g/mol) | 155.24 |
MDL Number | MFCD00209615 |
SMILES | CC(C)(C)CC(C)(C)N=C=O |
IUPAC Name | 2-isocyanato-2,4,4-trimethylpentane |
InChI Key | XOHBENIMDRFUIH-UHFFFAOYSA-N |
Molecular Formula | C9H17NO |
(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
PubChem CID | 7018272 |
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CAS | 745783-83-9 |
Molecular Weight (g/mol) | 177.203 |
MDL Number | MFCD05664085 |
SMILES | CC(C1=CC=C(C=C1)OC)N=C=O |
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 |
IUPAC Name | 1-[(1S)-1-isocyanatoethyl]-4-methoxybenzene |
InChI Key | WTNKKJUXEYSETC-QMMMGPOBSA-N |
Molecular Formula | C10H11NO2 |
(S)-(+)-1-(1-Naphthyl)ethyl isocyanate, 95%
CAS: 73671-79-1 Molecular Formula: C13H11NO Molecular Weight (g/mol): 197.24 MDL Number: MFCD00064181 InChI Key: GONOHGQPZFXJOJ-UHFFFAOYNA-N Synonym: s-+-1-1-naphthyl ethyl isocyanate,1-1s-1-isocyanatoethyl naphthalene,s-nei,s-1-1-naphthyl ethyl isocyanate,isocyanic acid s-+-1-1-naphthyl ethyl ester,1-1-isocyanatoethyl naphthalene #,pubchem8101,s-+-1-naphthyl ethyl isocyanate,s--1-1-naphthyl ethyl isocyanate,s-+-1-1-naphthyl ethylisocyanate PubChem CID: 7023510 IUPAC Name: 1-[(1S)-1-isocyanatoethyl]naphthalene SMILES: CC(N=C=O)C1=C2C=CC=CC2=CC=C1
PubChem CID | 7023510 |
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CAS | 73671-79-1 |
Molecular Weight (g/mol) | 197.24 |
MDL Number | MFCD00064181 |
SMILES | CC(N=C=O)C1=C2C=CC=CC2=CC=C1 |
Synonym | s-+-1-1-naphthyl ethyl isocyanate,1-1s-1-isocyanatoethyl naphthalene,s-nei,s-1-1-naphthyl ethyl isocyanate,isocyanic acid s-+-1-1-naphthyl ethyl ester,1-1-isocyanatoethyl naphthalene #,pubchem8101,s-+-1-naphthyl ethyl isocyanate,s--1-1-naphthyl ethyl isocyanate,s-+-1-1-naphthyl ethylisocyanate |
IUPAC Name | 1-[(1S)-1-isocyanatoethyl]naphthalene |
InChI Key | GONOHGQPZFXJOJ-UHFFFAOYNA-N |
Molecular Formula | C13H11NO |
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
PubChem CID | 589806 |
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CAS | 67531-68-4 |
Molecular Weight (g/mol) | 191.19 |
MDL Number | MFCD00013865 |
SMILES | CCOC(=O)C1=CC(=CC=C1)N=C=O |
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 |
IUPAC Name | ethyl 3-isocyanatobenzoate |
InChI Key | UPXGGIRFDZENRD-UHFFFAOYSA-N |
Molecular Formula | C10H9NO3 |
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
PubChem CID | 2733373 |
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CAS | 5100-34-5 |
Molecular Weight (g/mol) | 143.14 |
MDL Number | MFCD00078461 |
SMILES | CCOC(=O)CCN=C=O |
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 |
IUPAC Name | ethyl 3-isocyanatopropanoate |
InChI Key | XBSGYVHOINMTIM-UHFFFAOYSA-N |
Molecular Formula | C6H9NO3 |
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
PubChem CID | 2796313 |
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CAS | 69342-47-8 |
Molecular Weight (g/mol) | 175.231 |
MDL Number | MFCD00013882 |
SMILES | CCCCC1=CC=C(C=C1)N=C=O |
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 |
IUPAC Name | 1-butyl-4-isocyanatobenzene |
InChI Key | LJJRXPXDTAUVQU-UHFFFAOYSA-N |
Molecular Formula | C11H13NO |
3-Cyanophenyl isocyanate, 97%
CAS: 16413-26-6 Molecular Formula: C8H4N2O Molecular Weight (g/mol): 144.133 MDL Number: MFCD00013856 InChI Key: NZHPVPMRNASEQK-UHFFFAOYSA-N Synonym: 3-cyanophenyl isocyanate,3-cyanophenylisocyanate,benzonitrile, 3-isocyanato,3-isocyanatobenzenecarbonitrile,m-cyanophenyl isocyanate,m-cyanophenylisocyanate,pubchem5028,3-isocyanato-benzonitrile,acmc-1c7a7,paragos 331038 PubChem CID: 2733315 IUPAC Name: 3-isocyanatobenzonitrile SMILES: C1=CC(=CC(=C1)N=C=O)C#N
PubChem CID | 2733315 |
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CAS | 16413-26-6 |
Molecular Weight (g/mol) | 144.133 |
MDL Number | MFCD00013856 |
SMILES | C1=CC(=CC(=C1)N=C=O)C#N |
Synonym | 3-cyanophenyl isocyanate,3-cyanophenylisocyanate,benzonitrile, 3-isocyanato,3-isocyanatobenzenecarbonitrile,m-cyanophenyl isocyanate,m-cyanophenylisocyanate,pubchem5028,3-isocyanato-benzonitrile,acmc-1c7a7,paragos 331038 |
IUPAC Name | 3-isocyanatobenzonitrile |
InChI Key | NZHPVPMRNASEQK-UHFFFAOYSA-N |
Molecular Formula | C8H4N2O |