Organonitrogen Compounds
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tert-Butyl nitrite, 90%, pure
CAS: 540-80-7 InChI Key: IOGXOCVLYRDXLW-UHFFFAOYSA-N Synonym: t-butyl nitrite,1,1-dimethylethyl nitrite,tert-butylnitrite,nitrous acid, 1,1-dimethylethyl ester,unii-4780h7u8lu,ccris 2098,alpha,alpha-dimethylethyl nitrite,nitrous acid, t-butyl ester,2-methyl-2-propylnitrit,ch3 3cono PubChem CID: 10906 IUPAC Name: tert-butyl nitrite SMILES: CC(C)(C)ON=O
| PubChem CID | 10906 |
|---|---|
| CAS | 540-80-7 |
| SMILES | CC(C)(C)ON=O |
| Synonym | t-butyl nitrite,1,1-dimethylethyl nitrite,tert-butylnitrite,nitrous acid, 1,1-dimethylethyl ester,unii-4780h7u8lu,ccris 2098,alpha,alpha-dimethylethyl nitrite,nitrous acid, t-butyl ester,2-methyl-2-propylnitrit,ch3 3cono |
| IUPAC Name | tert-butyl nitrite |
| InChI Key | IOGXOCVLYRDXLW-UHFFFAOYSA-N |
Benzalkonium chloride
CAS: 63449-41-2 Molecular Formula: C21H38ClN Molecular Weight (g/mol): 339.99 MDL Number: MFCD00137276 InChI Key: JBIROUFYLSSYDX-UHFFFAOYSA-M Synonym: benzyldimethyldecylammonium chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride 1:1,quaternary ammonium compounds, benzyl-c8-18-alkyldimethyl, chlorides,roccal,benzyl decyl dimethylazanium chloride,tret-o-lite xc 511,ccris 4586,benzyl decyl dimethylammonium chloride,c8-18-alkydimethylbenzyl ammonium chlorides PubChem CID: 13762 IUPAC Name: benzyl-decyl-dimethylazanium;chloride SMILES: [Cl-].CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1
| PubChem CID | 13762 |
|---|---|
| CAS | 63449-41-2 |
| Molecular Weight (g/mol) | 339.99 |
| MDL Number | MFCD00137276 |
| SMILES | [Cl-].CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1 |
| Synonym | benzyldimethyldecylammonium chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride,benzenemethanaminium, n-decyl-n,n-dimethyl-, chloride 1:1,quaternary ammonium compounds, benzyl-c8-18-alkyldimethyl, chlorides,roccal,benzyl decyl dimethylazanium chloride,tret-o-lite xc 511,ccris 4586,benzyl decyl dimethylammonium chloride,c8-18-alkydimethylbenzyl ammonium chlorides |
| IUPAC Name | benzyl-decyl-dimethylazanium;chloride |
| InChI Key | JBIROUFYLSSYDX-UHFFFAOYSA-M |
| Molecular Formula | C21H38ClN |
1-Butylamine, 99%
CAS: 109-73-9 Molecular Formula: C4H11N Molecular Weight (g/mol): 73.139 MDL Number: MFCD00011690 InChI Key: HQABUPZFAYXKJW-UHFFFAOYSA-N Synonym: butylamine,n-butylamine,1-butanamine,1-aminobutane,1-butylamine,monobutylamine,n-butylamin,mono-n-butylamine,norvalamine,1-aminobutan PubChem CID: 8007 ChEBI: CHEBI:43799 IUPAC Name: butan-1-amine SMILES: CCCCN
| PubChem CID | 8007 |
|---|---|
| CAS | 109-73-9 |
| Molecular Weight (g/mol) | 73.139 |
| ChEBI | CHEBI:43799 |
| MDL Number | MFCD00011690 |
| SMILES | CCCCN |
| Synonym | butylamine,n-butylamine,1-butanamine,1-aminobutane,1-butylamine,monobutylamine,n-butylamin,mono-n-butylamine,norvalamine,1-aminobutan |
| IUPAC Name | butan-1-amine |
| InChI Key | HQABUPZFAYXKJW-UHFFFAOYSA-N |
| Molecular Formula | C4H11N |
Piperazine, anhydrous, 99%
CAS: 110-85-0 Molecular Formula: C4H10N2 Molecular Weight (g/mol): 86.14 MDL Number: MFCD00005953 InChI Key: GLUUGHFHXGJENI-UHFFFAOYSA-N Synonym: diethylenediamine,piperazin,1,4-diazacyclohexane,hexahydropyrazine,piperazidine,antiren,1,4-piperazine,diethyleneimine,eraverm,pipersol PubChem CID: 4837 ChEBI: CHEBI:28568 IUPAC Name: piperazine SMILES: C1CNCCN1
| PubChem CID | 4837 |
|---|---|
| CAS | 110-85-0 |
| Molecular Weight (g/mol) | 86.14 |
| ChEBI | CHEBI:28568 |
| MDL Number | MFCD00005953 |
| SMILES | C1CNCCN1 |
| Synonym | diethylenediamine,piperazin,1,4-diazacyclohexane,hexahydropyrazine,piperazidine,antiren,1,4-piperazine,diethyleneimine,eraverm,pipersol |
| IUPAC Name | piperazine |
| InChI Key | GLUUGHFHXGJENI-UHFFFAOYSA-N |
| Molecular Formula | C4H10N2 |
2-Amino-2-methyl-1-propanol, 95%, may cont. ca 5% water
CAS: 124-68-5 Molecular Formula: C4H11NO Molecular Weight (g/mol): 89.14 MDL Number: MFCD00008051 InChI Key: CBTVGIZVANVGBH-UHFFFAOYSA-N Synonym: 2-amino-2-methyl-1-propanol,isobutanol-2-amine,1-propanol, 2-amino-2-methyl,amp regular,2-aminoisobutanol,aminomethylpropanol,2-amino-2-methylpropanol,2-methyl-2-aminopropanol,2-aminodimethylethanol,hydroxy-tert-butylamine PubChem CID: 11807 IUPAC Name: 2-amino-2-methylpropan-1-ol SMILES: CC(C)(N)CO
| PubChem CID | 11807 |
|---|---|
| CAS | 124-68-5 |
| Molecular Weight (g/mol) | 89.14 |
| MDL Number | MFCD00008051 |
| SMILES | CC(C)(N)CO |
| Synonym | 2-amino-2-methyl-1-propanol,isobutanol-2-amine,1-propanol, 2-amino-2-methyl,amp regular,2-aminoisobutanol,aminomethylpropanol,2-amino-2-methylpropanol,2-methyl-2-aminopropanol,2-aminodimethylethanol,hydroxy-tert-butylamine |
| IUPAC Name | 2-amino-2-methylpropan-1-ol |
| InChI Key | CBTVGIZVANVGBH-UHFFFAOYSA-N |
| Molecular Formula | C4H11NO |
Benzyl azide, 94%
CAS: 622-79-7 Molecular Formula: C7H7N3 Molecular Weight (g/mol): 133.154 MDL Number: MFCD00013836 InChI Key: UDLLFLQFQMACJB-UHFFFAOYSA-N Synonym: azidomethyl benzene,benzyl azide,benzylazide,benzene, azidomethyl,alpha-azidotoluene,toluene, .alpha.-azido,unii-hfd57z7j9j,.alpha.-azidotoluene,ccris 8029 PubChem CID: 12152 IUPAC Name: azidomethylbenzene SMILES: C1=CC=C(C=C1)CN=[N+]=[N-]
| PubChem CID | 12152 |
|---|---|
| CAS | 622-79-7 |
| Molecular Weight (g/mol) | 133.154 |
| MDL Number | MFCD00013836 |
| SMILES | C1=CC=C(C=C1)CN=[N+]=[N-] |
| Synonym | azidomethyl benzene,benzyl azide,benzylazide,benzene, azidomethyl,alpha-azidotoluene,toluene, .alpha.-azido,unii-hfd57z7j9j,.alpha.-azidotoluene,ccris 8029 |
| IUPAC Name | azidomethylbenzene |
| InChI Key | UDLLFLQFQMACJB-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3 |
Tetra-n-octylammonium bromide, 98+%
CAS: 14866-33-2 Molecular Formula: C32H68BrN Molecular Weight (g/mol): 546.807 MDL Number: MFCD00011863 InChI Key: QBVXKDJEZKEASM-UHFFFAOYSA-M Synonym: tetraoctylammonium bromide,tetra-n-octylammonium bromide,tetraoctylazanium bromide,tetraoctyl ammonium bromide,1-octanaminium, n,n,n-trioctyl-, bromide,unii-52qw29owoc,52qw29owoc,tetra n-octyl ammonium bromide,acmc-1bvth,tetra-octylammonium bromide PubChem CID: 2734117 IUPAC Name: tetraoctylazanium;bromide SMILES: CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-]
| PubChem CID | 2734117 |
|---|---|
| CAS | 14866-33-2 |
| Molecular Weight (g/mol) | 546.807 |
| MDL Number | MFCD00011863 |
| SMILES | CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.[Br-] |
| Synonym | tetraoctylammonium bromide,tetra-n-octylammonium bromide,tetraoctylazanium bromide,tetraoctyl ammonium bromide,1-octanaminium, n,n,n-trioctyl-, bromide,unii-52qw29owoc,52qw29owoc,tetra n-octyl ammonium bromide,acmc-1bvth,tetra-octylammonium bromide |
| IUPAC Name | tetraoctylazanium;bromide |
| InChI Key | QBVXKDJEZKEASM-UHFFFAOYSA-M |
| Molecular Formula | C32H68BrN |
Chloroquine diphosphate salt, 98%
CAS: 50-63-5 Molecular Formula: C18H32ClN3O8P2 Molecular Weight (g/mol): 515.86 MDL Number: MFCD00069852 InChI Key: QKICWELGRMTQCR-UHFFFAOYNA-N Synonym: chloroquine diphosphate,chloroquine phosphate,aralen phosphate,chingamin phosphate,chloroquine bis phosphate,chingaminum,alermine,h-stadur,aralen diphosphate,miniquine PubChem CID: 64927 SMILES: OP(O)(O)=O.OP(O)(O)=O.CCN(CC)CCCC(C)NC1=C2C=CC(Cl)=CC2=NC=C1
| PubChem CID | 64927 |
|---|---|
| CAS | 50-63-5 |
| Molecular Weight (g/mol) | 515.86 |
| MDL Number | MFCD00069852 |
| SMILES | OP(O)(O)=O.OP(O)(O)=O.CCN(CC)CCCC(C)NC1=C2C=CC(Cl)=CC2=NC=C1 |
| Synonym | chloroquine diphosphate,chloroquine phosphate,aralen phosphate,chingamin phosphate,chloroquine bis phosphate,chingaminum,alermine,h-stadur,aralen diphosphate,miniquine |
| InChI Key | QKICWELGRMTQCR-UHFFFAOYNA-N |
| Molecular Formula | C18H32ClN3O8P2 |
Histamine dihydrochloride, 98+%
CAS: 56-92-8 Molecular Formula: C5H11Cl2N3 Molecular Weight (g/mol): 184.06 MDL Number: MFCD00012703 InChI Key: PPZMYIBUHIPZOS-UHFFFAOYSA-N Synonym: histamine dihydrochloride,histamine 2hcl,2-1h-imidazol-4-yl ethanamine dihydrochloride,1h-imidazole-4-ethanamine dihydrochloride,1h-imidazole-4-ethanamine, dihydrochloride,peremin,ceplene,2-1h-imidazol-4-yl ethylamine dihydrochloride,2-4-imidazolyl ethylamine dihydrochloride,histaminedium dichloride PubChem CID: 5818 IUPAC Name: 2-(1H-imidazol-5-yl)ethanamine;dihydrochloride SMILES: [H+].[H+].[Cl-].[Cl-].NCCC1=CN=CN1
| PubChem CID | 5818 |
|---|---|
| CAS | 56-92-8 |
| Molecular Weight (g/mol) | 184.06 |
| MDL Number | MFCD00012703 |
| SMILES | [H+].[H+].[Cl-].[Cl-].NCCC1=CN=CN1 |
| Synonym | histamine dihydrochloride,histamine 2hcl,2-1h-imidazol-4-yl ethanamine dihydrochloride,1h-imidazole-4-ethanamine dihydrochloride,1h-imidazole-4-ethanamine, dihydrochloride,peremin,ceplene,2-1h-imidazol-4-yl ethylamine dihydrochloride,2-4-imidazolyl ethylamine dihydrochloride,histaminedium dichloride |
| IUPAC Name | 2-(1H-imidazol-5-yl)ethanamine;dihydrochloride |
| InChI Key | PPZMYIBUHIPZOS-UHFFFAOYSA-N |
| Molecular Formula | C5H11Cl2N3 |
1,1,3,3-Tetramethylguanidine, 99%
CAS: 80-70-6 Molecular Weight (g/mol): 115.18 InChI Key: KYVBNYUBXIEUFW-UHFFFAOYSA-N Synonym: tetramethylguanidine,n,n,n',n'-tetramethylguanidine,guanidine, n,n,n',n'-tetramethyl,tetramethyl guanidine,unii-vez101e7zu,1,1,3,3-tetramethyl guanidine,n,n-1,1,3,3-tetramethylguanidine,vez101e7zu,1,1,3,3-tetramethyl-guanidine,n,n,n',n'-tetramethyl-guanidine PubChem CID: 66460 SMILES: CN(C)C(=N)N(C)C
| PubChem CID | 66460 |
|---|---|
| CAS | 80-70-6 |
| Molecular Weight (g/mol) | 115.18 |
| SMILES | CN(C)C(=N)N(C)C |
| Synonym | tetramethylguanidine,n,n,n',n'-tetramethylguanidine,guanidine, n,n,n',n'-tetramethyl,tetramethyl guanidine,unii-vez101e7zu,1,1,3,3-tetramethyl guanidine,n,n-1,1,3,3-tetramethylguanidine,vez101e7zu,1,1,3,3-tetramethyl-guanidine,n,n,n',n'-tetramethyl-guanidine |
| InChI Key | KYVBNYUBXIEUFW-UHFFFAOYSA-N |
N,N-Diisopropylethylamine, 99+%
CAS: 7087-68-5 Molecular Formula: C8H19N Molecular Weight (g/mol): 129.24 MDL Number: MFCD00008868 InChI Key: JGFZNNIVVJXRND-UHFFFAOYSA-N Synonym: n,n-diisopropylethylamine,ethyldiisopropylamine,n-ethyldiisopropylamine,diisopropylethylamine,diea,hunig's base,n-ethyl-n-isopropylpropan-2-amine,dipea,2-propanamine, n-ethyl-n-1-methylethyl,1,1'-dimethyltriethylamine PubChem CID: 81531 IUPAC Name: N-ethyl-N-propan-2-ylpropan-2-amine SMILES: CCN(C(C)C)C(C)C
| PubChem CID | 81531 |
|---|---|
| CAS | 7087-68-5 |
| Molecular Weight (g/mol) | 129.24 |
| MDL Number | MFCD00008868 |
| SMILES | CCN(C(C)C)C(C)C |
| Synonym | n,n-diisopropylethylamine,ethyldiisopropylamine,n-ethyldiisopropylamine,diisopropylethylamine,diea,hunig's base,n-ethyl-n-isopropylpropan-2-amine,dipea,2-propanamine, n-ethyl-n-1-methylethyl,1,1'-dimethyltriethylamine |
| IUPAC Name | N-ethyl-N-propan-2-ylpropan-2-amine |
| InChI Key | JGFZNNIVVJXRND-UHFFFAOYSA-N |
| Molecular Formula | C8H19N |
Cetyltrimethylammonium bromide, ∽98%, Molecular biology reagent grade, MP Biomedicals™
CAS: 57-09-0 Molecular Formula: C19H42BrN Molecular Weight (g/mol): 364.46 MDL Number: MFCD00011772 InChI Key: LZZYPRNAOMGNLH-UHFFFAOYSA-M Synonym: cetrimonium bromide,cetyltrimethylammonium bromide,hexadecyltrimethylammonium bromide,ctab,centimide,cetab,bromat,ctmab,cee dee,cetavlon PubChem CID: 5974 ChEBI: CHEBI:3567 IUPAC Name: hexadecyl(trimethyl)azanium;bromide SMILES: [Br-].CCCCCCCCCCCCCCCC[N+](C)(C)C
| PubChem CID | 5974 |
|---|---|
| CAS | 57-09-0 |
| Molecular Weight (g/mol) | 364.46 |
| ChEBI | CHEBI:3567 |
| MDL Number | MFCD00011772 |
| SMILES | [Br-].CCCCCCCCCCCCCCCC[N+](C)(C)C |
| Synonym | cetrimonium bromide,cetyltrimethylammonium bromide,hexadecyltrimethylammonium bromide,ctab,centimide,cetab,bromat,ctmab,cee dee,cetavlon |
| IUPAC Name | hexadecyl(trimethyl)azanium;bromide |
| InChI Key | LZZYPRNAOMGNLH-UHFFFAOYSA-M |
| Molecular Formula | C19H42BrN |
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
| PubChem CID | 169132 |
|---|---|
| CAS | 4098-71-9 |
| Molecular Weight (g/mol) | 222.29 |
| ChEBI | CHEBI:53214 |
| MDL Number | MFCD00064956 |
| SMILES | CC1(C)CC(CC(C)(CN=C=O)C1)N=C=O |
| 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 |
| IUPAC Name | 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane |
| InChI Key | NIMLQBUJDJZYEJ-UHFFFAOYNA-N |
| Molecular Formula | C12H18N2O2 |
2-Amino-2-methyl-1-propanol, 99%
CAS: 124-68-5 Molecular Formula: C4H11NO Molecular Weight (g/mol): 89.14 MDL Number: MFCD00008051 InChI Key: CBTVGIZVANVGBH-UHFFFAOYSA-N Synonym: 2-amino-2-methyl-1-propanol,isobutanol-2-amine,1-propanol, 2-amino-2-methyl,amp regular,2-aminoisobutanol,aminomethylpropanol,2-amino-2-methylpropanol,2-methyl-2-aminopropanol,2-aminodimethylethanol,hydroxy-tert-butylamine PubChem CID: 11807 IUPAC Name: 2-amino-2-methylpropan-1-ol SMILES: CC(C)(N)CO
| PubChem CID | 11807 |
|---|---|
| CAS | 124-68-5 |
| Molecular Weight (g/mol) | 89.14 |
| MDL Number | MFCD00008051 |
| SMILES | CC(C)(N)CO |
| Synonym | 2-amino-2-methyl-1-propanol,isobutanol-2-amine,1-propanol, 2-amino-2-methyl,amp regular,2-aminoisobutanol,aminomethylpropanol,2-amino-2-methylpropanol,2-methyl-2-aminopropanol,2-aminodimethylethanol,hydroxy-tert-butylamine |
| IUPAC Name | 2-amino-2-methylpropan-1-ol |
| InChI Key | CBTVGIZVANVGBH-UHFFFAOYSA-N |
| Molecular Formula | C4H11NO |
2,2-Bis(hydroxymethyl)-2,2',2″-nitrilotriethanol, 98%
CAS: 6976-37-0 Molecular Formula: C8H19NO5 Molecular Weight (g/mol): 209.24 MDL Number: MFCD00002853 InChI Key: OWMVSZAMULFTJU-UHFFFAOYSA-N Synonym: bis-tris,bistris,2,2-bis hydroxymethyl-2,2',2-nitrilotriethanol,bis 2-hydroxyethyl aminotris hydroxymethyl methane,bis-tris buffer,1,3-propanediol, 2-bis 2-hydroxyethyl amino-2-hydroxymethyl,unii-q1xc3631cp,bis 2-hydroxyethyl amino-tris hydroxymethyl methane,2-bis 2-hydroxyethyl amino-2-hydroxymethyl propane-1,3-diol,bis 2-hydroxyethyl iminotris hydroxymethyl methane PubChem CID: 81462 ChEBI: CHEBI:41250 IUPAC Name: 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)propane-1,3-diol SMILES: C(CO)N(CCO)C(CO)(CO)CO
| PubChem CID | 81462 |
|---|---|
| CAS | 6976-37-0 |
| Molecular Weight (g/mol) | 209.24 |
| ChEBI | CHEBI:41250 |
| MDL Number | MFCD00002853 |
| SMILES | C(CO)N(CCO)C(CO)(CO)CO |
| Synonym | bis-tris,bistris,2,2-bis hydroxymethyl-2,2',2-nitrilotriethanol,bis 2-hydroxyethyl aminotris hydroxymethyl methane,bis-tris buffer,1,3-propanediol, 2-bis 2-hydroxyethyl amino-2-hydroxymethyl,unii-q1xc3631cp,bis 2-hydroxyethyl amino-tris hydroxymethyl methane,2-bis 2-hydroxyethyl amino-2-hydroxymethyl propane-1,3-diol,bis 2-hydroxyethyl iminotris hydroxymethyl methane |
| IUPAC Name | 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)propane-1,3-diol |
| InChI Key | OWMVSZAMULFTJU-UHFFFAOYSA-N |
| Molecular Formula | C8H19NO5 |