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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

4-(Trifluoromethoxy)phenyl isocyanate, 97%, Thermo Scientific™

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
2

4-Isocyanatobenzeneboronic acid pinacol ester, 95%

CAS: 380430-64-8 Formule moléculaire: C13H16BNO3 Poids moléculaire (g/mol): 245.085 Numéro MDL: MFCD03411942 Clé InChI: RHKRIDVZGAXYQE-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 2773474 Nom IUPAC: 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

Poids moléculaire (g/mol) 245.085
Synonyme 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
Numéro MDL MFCD03411942
CAS 380430-64-8
CID PubChem 2773474
Nom IUPAC 2-(4-isocyanatophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Clé InChI RHKRIDVZGAXYQE-UHFFFAOYSA-N
SMILES B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)N=C=O
Formule moléculaire C13H16BNO3
3

Benzyl isocyanate, 99+%

CAS: 3173-56-6 Formule moléculaire: C8H7NO Poids moléculaire (g/mol): 133.15 Numéro MDL: MFCD00009701 Clé InChI: YDNLNVZZTACNJX-UHFFFAOYSA-N Synonyme: benzyl isocyanate,isocyanatomethyl benzene,benzylisocyanate,isocyanic acid benzyl ester,benzene, isocyanatomethyl,1-isocyanatomethyl benzene,phenylmethyl isocyanate,unii-8i2li357gq,phenylmethanisocyanate CID PubChem: 76639 Nom IUPAC: isocyanatomethylbenzene SMILES: O=C=NCC1=CC=CC=C1

Poids moléculaire (g/mol) 133.15
Synonyme benzyl isocyanate,isocyanatomethyl benzene,benzylisocyanate,isocyanic acid benzyl ester,benzene, isocyanatomethyl,1-isocyanatomethyl benzene,phenylmethyl isocyanate,unii-8i2li357gq,phenylmethanisocyanate
Numéro MDL MFCD00009701
CAS 3173-56-6
CID PubChem 76639
Nom IUPAC isocyanatomethylbenzene
Clé InChI YDNLNVZZTACNJX-UHFFFAOYSA-N
SMILES O=C=NCC1=CC=CC=C1
Formule moléculaire C8H7NO
4

(S)-(+)-2-Octyl isocyanate, 95%

CAS: 745783-87-3 Formule moléculaire: C9H17NO Poids moléculaire (g/mol): 155.241 Numéro MDL: MFCD05664089 Clé InChI: FTWPDIQXUDUDPL-VIFPVBQESA-N Synonyme: s-+-2-octyl isocyanate,2s-2-isocyanatooctane CID PubChem: 7018274 Nom IUPAC: (2S)-2-isocyanatooctane SMILES: CCCCCCC(C)N=C=O

Poids moléculaire (g/mol) 155.241
Synonyme s-+-2-octyl isocyanate,2s-2-isocyanatooctane
Numéro MDL MFCD05664089
CAS 745783-87-3
CID PubChem 7018274
Nom IUPAC (2S)-2-isocyanatooctane
Clé InChI FTWPDIQXUDUDPL-VIFPVBQESA-N
SMILES CCCCCCC(C)N=C=O
Formule moléculaire C9H17NO
5

(S)-(-)-α-Methylbenzyl isocyanate, ≥99.0% (sum of enantiomers, GC), MilliporeSigma™ Supelco™

Numéro MDL: MFCD00002036 Synonyme: (S)-(-)-1-Phenylethyl isocyanate

Synonyme (S)-(-)-1-Phenylethyl isocyanate
Numéro MDL MFCD00002036
6

2-Ethoxyphenyl isocyanate, 97%

CAS: 5395-71-1 Formule moléculaire: C9H9NO2 Poids moléculaire (g/mol): 163.18 Numéro MDL: MFCD00002007 Clé InChI: BUIQXUQLYZPMLS-UHFFFAOYSA-N Synonyme: 2-ethoxyphenyl isocyanate,o-ethoxyphenyl isocyanate,benzene, 1-ethoxy-2-isocyanato,isocyanic acid, o-ethoxyphenyl ester,2-ethoxyphenylisocyanate,2-ethoxybenzenisocyanate,acmc-20anwp,ethoxyphenyl isocyanate,2-ethoxy phenyl isocyanate,# CID PubChem: 79374 Nom IUPAC: 1-ethoxy-2-isocyanatobenzene SMILES: CCOC1=CC=CC=C1N=C=O

Poids moléculaire (g/mol) 163.18
Synonyme 2-ethoxyphenyl isocyanate,o-ethoxyphenyl isocyanate,benzene, 1-ethoxy-2-isocyanato,isocyanic acid, o-ethoxyphenyl ester,2-ethoxyphenylisocyanate,2-ethoxybenzenisocyanate,acmc-20anwp,ethoxyphenyl isocyanate,2-ethoxy phenyl isocyanate,#
Numéro MDL MFCD00002007
CAS 5395-71-1
CID PubChem 79374
Nom IUPAC 1-ethoxy-2-isocyanatobenzene
Clé InChI BUIQXUQLYZPMLS-UHFFFAOYSA-N
SMILES CCOC1=CC=CC=C1N=C=O
Formule moléculaire C9H9NO2
7

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
8

2-Isocyanatobenzonitrile, 97%, Thermo Scientific™

CAS: 42066-86-4 Formule moléculaire: C8H4N2O Poids moléculaire (g/mol): 144.133 Clé InChI: FQLNVWAFXQUXGW-UHFFFAOYSA-N CID PubChem: 2735873 Nom IUPAC: 2-isocyanatobenzonitrile SMILES: C1=CC=C(C(=C1)C#N)N=C=O

Poids moléculaire (g/mol) 144.133
CAS 42066-86-4
CID PubChem 2735873
Nom IUPAC 2-isocyanatobenzonitrile
Clé InChI FQLNVWAFXQUXGW-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)C#N)N=C=O
Formule moléculaire C8H4N2O
9

2-Chloroethyl isocyanate, 98%

CAS: 1943-83-5 Formule moléculaire: C3H4ClNO Poids moléculaire (g/mol): 105.52 Numéro MDL: MFCD00002043 Clé InChI: BCMYXYHEMGPZJN-UHFFFAOYSA-N Synonyme: 2-chloroethyl isocyanate,2-chloroethylisocyanate,chloroethylisocyanate,ethane, 1-chloro-2-isocyanato,2-chlorethylisokyanat,2-chloro ethyl isocyanate,isocyanic acid, 2-chloroethyl ester,1-chloro-2-isocyanato-ethane,2-chlorethylisokyanat czech,.beta.-chloroethylisocyanate CID PubChem: 16035 Nom IUPAC: 1-chloro-2-isocyanatoethane SMILES: C(CCl)N=C=O

Poids moléculaire (g/mol) 105.52
Synonyme 2-chloroethyl isocyanate,2-chloroethylisocyanate,chloroethylisocyanate,ethane, 1-chloro-2-isocyanato,2-chlorethylisokyanat,2-chloro ethyl isocyanate,isocyanic acid, 2-chloroethyl ester,1-chloro-2-isocyanato-ethane,2-chlorethylisokyanat czech,.beta.-chloroethylisocyanate
Numéro MDL MFCD00002043
CAS 1943-83-5
CID PubChem 16035
Nom IUPAC 1-chloro-2-isocyanatoethane
Clé InChI BCMYXYHEMGPZJN-UHFFFAOYSA-N
SMILES C(CCl)N=C=O
Formule moléculaire C3H4ClNO
10

3,4-Dichlorobenzyl isocyanate, 98%

CAS: 19752-09-1 Formule moléculaire: C8H5Cl2NO Poids moléculaire (g/mol): 202.04 Numéro MDL: MFCD00673063 Clé InChI: WLNAHQZFPSSVTP-UHFFFAOYSA-N Synonyme: 3,4-dichlorobenzyl isocyanate,3,4-dichlorobenzylisocyanate,1,2-dichloro-4-isocyanatomethyl benzene,benzene, 1,2-dichloro-4-isocyanatomethyl,1,2-dichloro-4-isocyanatomethyl-benzene,3,4-dichlorophenyl methanisocyanate,zlchem 123,acmc-20anfi,pubchem2096,3,4-dichloro-benzyl isocyanate CID PubChem: 2733368 Nom IUPAC: 1,2-dichloro-4-(isocyanatomethyl)benzene SMILES: C1=CC(=C(C=C1CN=C=O)Cl)Cl

Poids moléculaire (g/mol) 202.04
Synonyme 3,4-dichlorobenzyl isocyanate,3,4-dichlorobenzylisocyanate,1,2-dichloro-4-isocyanatomethyl benzene,benzene, 1,2-dichloro-4-isocyanatomethyl,1,2-dichloro-4-isocyanatomethyl-benzene,3,4-dichlorophenyl methanisocyanate,zlchem 123,acmc-20anfi,pubchem2096,3,4-dichloro-benzyl isocyanate
Numéro MDL MFCD00673063
CAS 19752-09-1
CID PubChem 2733368
Nom IUPAC 1,2-dichloro-4-(isocyanatomethyl)benzene
Clé InChI WLNAHQZFPSSVTP-UHFFFAOYSA-N
SMILES C1=CC(=C(C=C1CN=C=O)Cl)Cl
Formule moléculaire C8H5Cl2NO
11

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
12

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
13

Isophorone diisocyanate, mixture of isomers, 98%

CAS: 4098-71-9 Formule moléculaire: C12H18N2O2 Poids moléculaire (g/mol): 222.29 Numéro MDL: MFCD00064956 Clé InChI: NIMLQBUJDJZYEJ-UHFFFAOYNA-N Synonyme: 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 CID PubChem: 169132 ChEBI: CHEBI:53214 Nom IUPAC: 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane SMILES: CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O

Poids moléculaire (g/mol) 222.29
Synonyme 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
Numéro MDL MFCD00064956
CAS 4098-71-9
CID PubChem 169132
ChEBI CHEBI:53214
Nom IUPAC 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane
Clé InChI NIMLQBUJDJZYEJ-UHFFFAOYNA-N
SMILES CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O
Formule moléculaire C12H18N2O2
14

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
15

4-n-Butoxyphenyl isocyanate, 98%

CAS: 28439-86-3 Formule moléculaire: C11H13NO2 Poids moléculaire (g/mol): 191.23 Numéro MDL: MFCD00037042 Clé InChI: ASFIDVOMDQBCNP-UHFFFAOYSA-N Synonyme: 4-n-butoxyphenyl isocyanate,4-butoxyphenyl isocyanate,benzene, 1-butoxy-4-isocyanato,1-butoxy-4-isocyanato-benzene,pubchem16232,4-butoxybenzenisocyanate CID PubChem: 2769629 Nom IUPAC: 1-butoxy-4-isocyanatobenzene SMILES: CCCCOC1=CC=C(C=C1)N=C=O

Poids moléculaire (g/mol) 191.23
Synonyme 4-n-butoxyphenyl isocyanate,4-butoxyphenyl isocyanate,benzene, 1-butoxy-4-isocyanato,1-butoxy-4-isocyanato-benzene,pubchem16232,4-butoxybenzenisocyanate
Numéro MDL MFCD00037042
CAS 28439-86-3
CID PubChem 2769629
Nom IUPAC 1-butoxy-4-isocyanatobenzene
Clé InChI ASFIDVOMDQBCNP-UHFFFAOYSA-N
SMILES CCCCOC1=CC=C(C=C1)N=C=O
Formule moléculaire C11H13NO2