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Isocyanates

Organic compounds that contain a nitrogen atom bonded to a carbon atom that is bonded to an oxygen atom, both bonds are double bonds, in the following structure: R-N=C=O, where R is any carbon chain or group.
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1 – 15 de 109 résultats
1

3-(Methoxycarbonyl)phenyl isocyanate, 97%

CAS: 41221-47-0 Formule moléculaire: C9H7NO3 Poids moléculaire (g/mol): 177.16 Numéro MDL: MFCD00037077 Clé InChI: WBGWGERFPSYHDT-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 2733366 Nom IUPAC: methyl 3-isocyanatobenzoate SMILES: COC(=O)C1=CC=CC(=C1)N=C=O

Poids moléculaire (g/mol) 177.16
Synonyme 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
Numéro MDL MFCD00037077
CAS 41221-47-0
CID PubChem 2733366
Nom IUPAC methyl 3-isocyanatobenzoate
Clé InChI WBGWGERFPSYHDT-UHFFFAOYSA-N
SMILES COC(=O)C1=CC=CC(=C1)N=C=O
Formule moléculaire C9H7NO3
2

Hexyl isocyanate, 99%

CAS: 2525-62-4 Formule moléculaire: C7H13NO Poids moléculaire (g/mol): 127.19 Numéro MDL: MFCD00037047 Clé InChI: ANJPRQPHZGHVQB-UHFFFAOYSA-N Synonyme: hexyl isocyanate,hexane, 1-isocyanato,1-hexyl isocyanate,hexylmonoisocyanate,hexyl monoisocyanate,hexylisocyanate,n-hexyl isocyanate,hexanisocyanate,isocyanatohexane,isocyanato-hexane CID PubChem: 75659 ChEBI: CHEBI:59058 Nom IUPAC: 1-isocyanatohexane SMILES: CCCCCCN=C=O

Poids moléculaire (g/mol) 127.19
Synonyme hexyl isocyanate,hexane, 1-isocyanato,1-hexyl isocyanate,hexylmonoisocyanate,hexyl monoisocyanate,hexylisocyanate,n-hexyl isocyanate,hexanisocyanate,isocyanatohexane,isocyanato-hexane
Numéro MDL MFCD00037047
CAS 2525-62-4
CID PubChem 75659
ChEBI CHEBI:59058
Nom IUPAC 1-isocyanatohexane
Clé InChI ANJPRQPHZGHVQB-UHFFFAOYSA-N
SMILES CCCCCCN=C=O
Formule moléculaire C7H13NO
3

4-Nitrophenyl isocyanate, 97%

CAS: 100-28-7 Formule moléculaire: C7H4N2O3 Poids moléculaire (g/mol): 164.12 Numéro MDL: MFCD00007306 Clé InChI: GFNKTLQTQSALEJ-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 66012 Nom IUPAC: 1-isocyanato-4-nitrobenzene SMILES: C1=CC(=CC=C1N=C=O)[N+](=O)[O-]

Poids moléculaire (g/mol) 164.12
Synonyme 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
Numéro MDL MFCD00007306
CAS 100-28-7
CID PubChem 66012
Nom IUPAC 1-isocyanato-4-nitrobenzene
Clé InChI GFNKTLQTQSALEJ-UHFFFAOYSA-N
SMILES C1=CC(=CC=C1N=C=O)[N+](=O)[O-]
Formule moléculaire C7H4N2O3
4

Allyl isocyanate, 96%

CAS: 1476-23-9 Formule moléculaire: C4H5NO Poids moléculaire (g/mol): 83.09 Numéro MDL: MFCD00002044 Clé InChI: HXBPYFMVGFDZFT-UHFFFAOYSA-N CID PubChem: 15123 Nom IUPAC: 3-isocyanatoprop-1-ene SMILES: C=CCN=C=O

Poids moléculaire (g/mol) 83.09
Numéro MDL MFCD00002044
CAS 1476-23-9
CID PubChem 15123
Nom IUPAC 3-isocyanatoprop-1-ene
Clé InChI HXBPYFMVGFDZFT-UHFFFAOYSA-N
SMILES C=CCN=C=O
Formule moléculaire C4H5NO
5

2,4,6-Trimethylphenyl isocyanate, 98%

CAS: 2958-62-5 Formule moléculaire: C10H11NO Poids moléculaire (g/mol): 161.204 Numéro MDL: MFCD00019909 Clé InChI: HJHZRZFONUPQAA-UHFFFAOYSA-N Synonyme: 2,4,6-trimethylphenyl isocyanate,mesityl isocyanate,2,4,6-trimethylphenylisocyanate,acmc-1ckns,2,4,6-trimethylbenzenisocyanate,2-isocyanato-1,3,5-trimethyl-benzene,# CID PubChem: 595239 Nom IUPAC: 2-isocyanato-1,3,5-trimethylbenzene SMILES: CC1=CC(=C(C(=C1)C)N=C=O)C

Poids moléculaire (g/mol) 161.204
Synonyme 2,4,6-trimethylphenyl isocyanate,mesityl isocyanate,2,4,6-trimethylphenylisocyanate,acmc-1ckns,2,4,6-trimethylbenzenisocyanate,2-isocyanato-1,3,5-trimethyl-benzene,#
Numéro MDL MFCD00019909
CAS 2958-62-5
CID PubChem 595239
Nom IUPAC 2-isocyanato-1,3,5-trimethylbenzene
Clé InChI HJHZRZFONUPQAA-UHFFFAOYSA-N
SMILES CC1=CC(=C(C(=C1)C)N=C=O)C
Formule moléculaire C10H11NO
7

2-Ethylphenyl isocyanate, 99%

CAS: 40411-25-4 Formule moléculaire: C9H9NO Poids moléculaire (g/mol): 147.177 Numéro MDL: MFCD00002013 Clé InChI: ZVFNUQWYLXXSJM-UHFFFAOYSA-N Synonyme: 2-ethylphenyl isocyanate,2-ethylphenylisocyanate,o-ethylphenyl isocyanate,benzene, ethylisocyanato,2-ethylbenzenisocyanate,2-eth-ylphenyl isocyanate,2-ethyl phenyl isocyanate,2-ethyl-phenyl isocyanate,acmc-1amc4,1-ethyl-2-isocyanato-benzene CID PubChem: 583486 Nom IUPAC: 1-ethyl-2-isocyanatobenzene SMILES: CCC1=CC=CC=C1N=C=O

Poids moléculaire (g/mol) 147.177
Synonyme 2-ethylphenyl isocyanate,2-ethylphenylisocyanate,o-ethylphenyl isocyanate,benzene, ethylisocyanato,2-ethylbenzenisocyanate,2-eth-ylphenyl isocyanate,2-ethyl phenyl isocyanate,2-ethyl-phenyl isocyanate,acmc-1amc4,1-ethyl-2-isocyanato-benzene
Numéro MDL MFCD00002013
CAS 40411-25-4
CID PubChem 583486
Nom IUPAC 1-ethyl-2-isocyanatobenzene
Clé InChI ZVFNUQWYLXXSJM-UHFFFAOYSA-N
SMILES CCC1=CC=CC=C1N=C=O
Formule moléculaire C9H9NO
8

4-(Trifluoromethoxy)phenyl isocyanate, 97%

CAS: 35037-73-1 Formule moléculaire: C8H4F3NO2 Poids moléculaire (g/mol): 203.12 Numéro MDL: MFCD00035702 Clé InChI: LGPKFIGMLPDYEA-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 92298 Nom IUPAC: 1-isocyanato-4-(trifluoromethoxy)benzene SMILES: C1=CC(=CC=C1N=C=O)OC(F)(F)F

Poids moléculaire (g/mol) 203.12
Synonyme 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
Numéro MDL MFCD00035702
CAS 35037-73-1
CID PubChem 92298
Nom IUPAC 1-isocyanato-4-(trifluoromethoxy)benzene
Clé InChI LGPKFIGMLPDYEA-UHFFFAOYSA-N
SMILES C1=CC(=CC=C1N=C=O)OC(F)(F)F
Formule moléculaire C8H4F3NO2
9

4-Ethoxyphenyl isocyanate, 97%

CAS: 32459-62-4 Formule moléculaire: C9H9NO2 Poids moléculaire (g/mol): 163.18 Numéro MDL: MFCD00013877 Clé InChI: FMYVTFRADSNGDN-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 122887 Nom IUPAC: 1-ethoxy-4-isocyanatobenzene SMILES: CCOC1=CC=C(C=C1)N=C=O

Poids moléculaire (g/mol) 163.18
Synonyme 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
Numéro MDL MFCD00013877
CAS 32459-62-4
CID PubChem 122887
Nom IUPAC 1-ethoxy-4-isocyanatobenzene
Clé InChI FMYVTFRADSNGDN-UHFFFAOYSA-N
SMILES CCOC1=CC=C(C=C1)N=C=O
Formule moléculaire C9H9NO2
10

(S)-(-)-1-Phenylethyl isocyanate, 98%

CAS: 14649-03-7 Formule moléculaire: C9H9NO Poids moléculaire (g/mol): 147.177 Numéro MDL: MFCD00002036 Clé InChI: JJSCUXAFAJEQGB-QMMMGPOBSA-N Synonyme: 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 # CID PubChem: 2724173 Nom IUPAC: [(1S)-1-isocyanatoethyl]benzene SMILES: CC(C1=CC=CC=C1)N=C=O

Poids moléculaire (g/mol) 147.177
Synonyme 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 #
Numéro MDL MFCD00002036
CAS 14649-03-7
CID PubChem 2724173
Nom IUPAC [(1S)-1-isocyanatoethyl]benzene
Clé InChI JJSCUXAFAJEQGB-QMMMGPOBSA-N
SMILES CC(C1=CC=CC=C1)N=C=O
Formule moléculaire C9H9NO
11

3,5-Dichlorophenyl isocyanate, 97%

CAS: 34893-92-0 Formule moléculaire: C7H3Cl2NO Poids moléculaire (g/mol): 188.007 Numéro MDL: MFCD00013859 Clé InChI: XEFUJGURFLOFAN-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 94460 Nom IUPAC: 1,3-dichloro-5-isocyanatobenzene SMILES: C1=C(C=C(C=C1Cl)Cl)N=C=O

Poids moléculaire (g/mol) 188.007
Synonyme 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
Numéro MDL MFCD00013859
CAS 34893-92-0
CID PubChem 94460
Nom IUPAC 1,3-dichloro-5-isocyanatobenzene
Clé InChI XEFUJGURFLOFAN-UHFFFAOYSA-N
SMILES C1=C(C=C(C=C1Cl)Cl)N=C=O
Formule moléculaire C7H3Cl2NO
12

o-Tolyl isocyanate, 98%

CAS: 614-68-6 Formule moléculaire: C8H7NO Poids moléculaire (g/mol): 133.15 Numéro MDL: MFCD00002009 Clé InChI: VAYMIYBJLRRIFR-UHFFFAOYSA-N Synonyme: o-tolyl isocyanate,2-methylphenyl isocyanate,2-tolyl isocyanate,o-methylphenyl isocyanate,o-toluene isocyanate,benzene, 1-isocyanato-2-methyl,2-methylphenylisocyanate,tolyl isocyanate,isocyanic acid, o-tolyl ester,o-tolylisocyanate CID PubChem: 69194 ChEBI: CHEBI:60099 Nom IUPAC: 1-isocyanato-2-methylbenzene SMILES: CC1=CC=CC=C1N=C=O

Poids moléculaire (g/mol) 133.15
Synonyme o-tolyl isocyanate,2-methylphenyl isocyanate,2-tolyl isocyanate,o-methylphenyl isocyanate,o-toluene isocyanate,benzene, 1-isocyanato-2-methyl,2-methylphenylisocyanate,tolyl isocyanate,isocyanic acid, o-tolyl ester,o-tolylisocyanate
Numéro MDL MFCD00002009
CAS 614-68-6
CID PubChem 69194
ChEBI CHEBI:60099
Nom IUPAC 1-isocyanato-2-methylbenzene
Clé InChI VAYMIYBJLRRIFR-UHFFFAOYSA-N
SMILES CC1=CC=CC=C1N=C=O
Formule moléculaire C8H7NO
13

(S)-(+)-1-(1-Naphthyl)ethyl isocyanate, 95%

CAS: 73671-79-1 Formule moléculaire: C13H11NO Poids moléculaire (g/mol): 197.24 Numéro MDL: MFCD00064181 Clé InChI: GONOHGQPZFXJOJ-UHFFFAOYNA-N Synonyme: 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 CID PubChem: 7023510 Nom IUPAC: 1-[(1S)-1-isocyanatoethyl]naphthalene SMILES: CC(N=C=O)C1=C2C=CC=CC2=CC=C1

Poids moléculaire (g/mol) 197.24
Synonyme 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
Numéro MDL MFCD00064181
CAS 73671-79-1
CID PubChem 7023510
Nom IUPAC 1-[(1S)-1-isocyanatoethyl]naphthalene
Clé InChI GONOHGQPZFXJOJ-UHFFFAOYNA-N
SMILES CC(N=C=O)C1=C2C=CC=CC2=CC=C1
Formule moléculaire C13H11NO
14

2,6-Diethylphenyl isocyanate, 98+%

CAS: 20458-99-5 Formule moléculaire: C11H13NO Poids moléculaire (g/mol): 175.23 Numéro MDL: MFCD00019912 Clé InChI: AUSRFKVPUCQCCN-UHFFFAOYSA-N Synonyme: 2,6-diethylphenyl isocyanate,2,6-diethylphenylisocyanate,1,3-diethyl-2-isocyanato-benzene,benzene, 1,3-diethyl-2-isocyanato,acmc-1co7s,2,6-diethylbenzenisocyanate,benzene,1,3-diethyl-2-isocyanato CID PubChem: 5153183 Nom IUPAC: 1,3-diethyl-2-isocyanatobenzene SMILES: CCC1=CC=CC(CC)=C1N=C=O

Poids moléculaire (g/mol) 175.23
Synonyme 2,6-diethylphenyl isocyanate,2,6-diethylphenylisocyanate,1,3-diethyl-2-isocyanato-benzene,benzene, 1,3-diethyl-2-isocyanato,acmc-1co7s,2,6-diethylbenzenisocyanate,benzene,1,3-diethyl-2-isocyanato
Numéro MDL MFCD00019912
CAS 20458-99-5
CID PubChem 5153183
Nom IUPAC 1,3-diethyl-2-isocyanatobenzene
Clé InChI AUSRFKVPUCQCCN-UHFFFAOYSA-N
SMILES CCC1=CC=CC(CC)=C1N=C=O
Formule moléculaire C11H13NO
15

3-Nitrophenyl isocyanate, 97%, Thermo Scientific Chemicals

CAS: 3320-87-4 Formule moléculaire: C7H4N2O3 Poids moléculaire (g/mol): 164.12 Numéro MDL: MFCD00007220 Clé InChI: GFFGYTMCNVMFAJ-UHFFFAOYSA-N Synonyme: 3-nitrophenyl isocyanate,m-nitrophenyl isocyanate,benzene, 1-isocyanato-3-nitro,3-nitrophenylisocyanate,isocyanic acid, m-nitrophenyl ester,3-nitrobenzenisocyanate,m-nitrophenylisocyanate,3-nitropheny isocyanate,pubchem15729,acmc-1ckin CID PubChem: 76835 Nom IUPAC: 1-isocyanato-3-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC(=C1)N=C=O

Poids moléculaire (g/mol) 164.12
Synonyme 3-nitrophenyl isocyanate,m-nitrophenyl isocyanate,benzene, 1-isocyanato-3-nitro,3-nitrophenylisocyanate,isocyanic acid, m-nitrophenyl ester,3-nitrobenzenisocyanate,m-nitrophenylisocyanate,3-nitropheny isocyanate,pubchem15729,acmc-1ckin
Numéro MDL MFCD00007220
CAS 3320-87-4
CID PubChem 76835
Nom IUPAC 1-isocyanato-3-nitrobenzene
Clé InChI GFFGYTMCNVMFAJ-UHFFFAOYSA-N
SMILES [O-][N+](=O)C1=CC=CC(=C1)N=C=O
Formule moléculaire C7H4N2O3