Organonitrogen Compounds
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Creatine monohydrate, 99%
CAS: 6020-87-7 Molecular Formula: C4H11N3O3 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00071582 InChI Key: MEJYXFHCRXAUIL-UHFFFAOYSA-N Synonym: creatine monohydrate,creatine hydrate,2-1-methylguanidino acetic acid hydrate,creatine, monohydrate,creatinemonohydrate,unii-9603ln7r2q,glycine, n-aminoiminomethyl-n-methyl-, monohydrate,n-amidinosarcosine monohydrate,n-aminoiminomethyl-n-methylglycine monohydrate,creapure PubChem CID: 80116 IUPAC Name: 2-[carbamimidoyl(methyl)amino]acetic acid;hydrate SMILES: CN(CC(=O)O)C(=N)N.O
| PubChem CID | 80116 |
|---|---|
| CAS | 6020-87-7 |
| Molecular Weight (g/mol) | 149.15 |
| MDL Number | MFCD00071582 |
| SMILES | CN(CC(=O)O)C(=N)N.O |
| Synonym | creatine monohydrate,creatine hydrate,2-1-methylguanidino acetic acid hydrate,creatine, monohydrate,creatinemonohydrate,unii-9603ln7r2q,glycine, n-aminoiminomethyl-n-methyl-, monohydrate,n-amidinosarcosine monohydrate,n-aminoiminomethyl-n-methylglycine monohydrate,creapure |
| IUPAC Name | 2-[carbamimidoyl(methyl)amino]acetic acid;hydrate |
| InChI Key | MEJYXFHCRXAUIL-UHFFFAOYSA-N |
| Molecular Formula | C4H11N3O3 |
Dodecyltrimethylammonium chloride, 98%
CAS: 112-00-5 Molecular Formula: C15H34ClN Molecular Weight (g/mol): 263.88 MDL Number: MFCD00041974 InChI Key: DDXLVDQZPFLQMZ-UHFFFAOYSA-M Synonym: dodecyltrimethylammonium chloride,alicop,cation bb,aliquat 4,n,n,n-trimethyldodecan-1-aminium chloride,laurtrimonium chloride,dehyquart lt,cation fb,nissan cation bb,lauryltrimethylammonium chloride PubChem CID: 8152 IUPAC Name: dodecyl(trimethyl)azanium;chloride SMILES: CCCCCCCCCCCC[N+](C)(C)C.[Cl-]
| PubChem CID | 8152 |
|---|---|
| CAS | 112-00-5 |
| Molecular Weight (g/mol) | 263.88 |
| MDL Number | MFCD00041974 |
| SMILES | CCCCCCCCCCCC[N+](C)(C)C.[Cl-] |
| Synonym | dodecyltrimethylammonium chloride,alicop,cation bb,aliquat 4,n,n,n-trimethyldodecan-1-aminium chloride,laurtrimonium chloride,dehyquart lt,cation fb,nissan cation bb,lauryltrimethylammonium chloride |
| IUPAC Name | dodecyl(trimethyl)azanium;chloride |
| InChI Key | DDXLVDQZPFLQMZ-UHFFFAOYSA-M |
| Molecular Formula | C15H34ClN |
Bis(2-dimethylaminoethyl) ether, 98%
CAS: 3033-62-3 Molecular Formula: C8H20N2O Molecular Weight (g/mol): 160.26 MDL Number: MFCD00059199 InChI Key: GTEXIOINCJRBIO-UHFFFAOYSA-N Synonym: bis 2-dimethylaminoethyl ether,niax catalyst al,kalpur pc,toyocat ets,niax a 1,texacat zf 20,dabco bl 19i,dabco bl 11,dabco bl 19 PubChem CID: 18204 IUPAC Name: 2-[2-(dimethylamino)ethoxy]-N,N-dimethylethanamine SMILES: CN(C)CCOCCN(C)C
| PubChem CID | 18204 |
|---|---|
| CAS | 3033-62-3 |
| Molecular Weight (g/mol) | 160.26 |
| MDL Number | MFCD00059199 |
| SMILES | CN(C)CCOCCN(C)C |
| Synonym | bis 2-dimethylaminoethyl ether,niax catalyst al,kalpur pc,toyocat ets,niax a 1,texacat zf 20,dabco bl 19i,dabco bl 11,dabco bl 19 |
| IUPAC Name | 2-[2-(dimethylamino)ethoxy]-N,N-dimethylethanamine |
| InChI Key | GTEXIOINCJRBIO-UHFFFAOYSA-N |
| Molecular Formula | C8H20N2O |
N-Methylaniline, 99%
CAS: 100-61-8 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 MDL Number: MFCD00008283 InChI Key: AFBPFSWMIHJQDM-UHFFFAOYSA-N Synonym: methylaniline,monomethylaniline,n-methyl aniline,benzenamine, n-methyl,methylphenylamine,n-methylbenzenamine,n-monomethylaniline,n-methylaminobenzene,methylamino benzene,anilinomethane PubChem CID: 7515 ChEBI: CHEBI:15733 IUPAC Name: N-methylaniline SMILES: CNC1=CC=CC=C1
| PubChem CID | 7515 |
|---|---|
| CAS | 100-61-8 |
| Molecular Weight (g/mol) | 107.16 |
| ChEBI | CHEBI:15733 |
| MDL Number | MFCD00008283 |
| SMILES | CNC1=CC=CC=C1 |
| Synonym | methylaniline,monomethylaniline,n-methyl aniline,benzenamine, n-methyl,methylphenylamine,n-methylbenzenamine,n-monomethylaniline,n-methylaminobenzene,methylamino benzene,anilinomethane |
| IUPAC Name | N-methylaniline |
| InChI Key | AFBPFSWMIHJQDM-UHFFFAOYSA-N |
| Molecular Formula | C7H9N |
3-Aminopropionitrile, 98%, stabilized
CAS: 151-18-8 Molecular Formula: C3H6N2 Molecular Weight (g/mol): 70.10 MDL Number: MFCD00014820 InChI Key: AGSPXMVUFBBBMO-UHFFFAOYSA-N Synonym: 3-aminopropionitrile,2-cyanoethylamine,aminopropionitrile,beta-aminopropionitrile,bapn,3-aminopropiononitrile,beta-cyanoethylamine,propanenitrile, 3-amino,beta-alaninenitrile,propionitrile, 3-amino PubChem CID: 1647 ChEBI: CHEBI:27413 IUPAC Name: 3-aminopropanenitrile SMILES: NCCC#N
| PubChem CID | 1647 |
|---|---|
| CAS | 151-18-8 |
| Molecular Weight (g/mol) | 70.10 |
| ChEBI | CHEBI:27413 |
| MDL Number | MFCD00014820 |
| SMILES | NCCC#N |
| Synonym | 3-aminopropionitrile,2-cyanoethylamine,aminopropionitrile,beta-aminopropionitrile,bapn,3-aminopropiononitrile,beta-cyanoethylamine,propanenitrile, 3-amino,beta-alaninenitrile,propionitrile, 3-amino |
| IUPAC Name | 3-aminopropanenitrile |
| InChI Key | AGSPXMVUFBBBMO-UHFFFAOYSA-N |
| Molecular Formula | C3H6N2 |
2-Phenylethylamine, 99%
CAS: 64-04-0 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.183 MDL Number: MFCD00008184 InChI Key: BHHGXPLMPWCGHP-UHFFFAOYSA-N Synonym: phenethylamine,2-phenylethylamine,benzeneethanamine,phenylethylamine,2-phenethylamine,beta-phenylethylamine,beta-phenethylamine,1-amino-2-phenylethane,2-aminoethyl benzene,beta-aminoethylbenzene PubChem CID: 1001 ChEBI: CHEBI:18397 IUPAC Name: 2-phenylethanamine SMILES: C1=CC=C(C=C1)CCN
| PubChem CID | 1001 |
|---|---|
| CAS | 64-04-0 |
| Molecular Weight (g/mol) | 121.183 |
| ChEBI | CHEBI:18397 |
| MDL Number | MFCD00008184 |
| SMILES | C1=CC=C(C=C1)CCN |
| Synonym | phenethylamine,2-phenylethylamine,benzeneethanamine,phenylethylamine,2-phenethylamine,beta-phenylethylamine,beta-phenethylamine,1-amino-2-phenylethane,2-aminoethyl benzene,beta-aminoethylbenzene |
| IUPAC Name | 2-phenylethanamine |
| InChI Key | BHHGXPLMPWCGHP-UHFFFAOYSA-N |
| Molecular Formula | C8H11N |
2-Methylbutylamine, 98%
CAS: 96-15-1 Molecular Formula: C5H13N Molecular Weight (g/mol): 87.16 MDL Number: MFCD00008147 InChI Key: VJROPLWGFCORRM-UHFFFAOYSA-N Synonym: 2-methylbutylamine,1-butanamine, 2-methyl,1-amino-2-methylbutane,2-methylbutyl amine,2-methyl-1-butylamine,2-methylbutanamine,2-methyl-1-butanamine,butylamine, 2-methyl,1-amino-2-methyl-butane,2-methyl-butylamine PubChem CID: 7283 IUPAC Name: 2-methylbutan-1-amine SMILES: CCC(C)CN
| PubChem CID | 7283 |
|---|---|
| CAS | 96-15-1 |
| Molecular Weight (g/mol) | 87.16 |
| MDL Number | MFCD00008147 |
| SMILES | CCC(C)CN |
| Synonym | 2-methylbutylamine,1-butanamine, 2-methyl,1-amino-2-methylbutane,2-methylbutyl amine,2-methyl-1-butylamine,2-methylbutanamine,2-methyl-1-butanamine,butylamine, 2-methyl,1-amino-2-methyl-butane,2-methyl-butylamine |
| IUPAC Name | 2-methylbutan-1-amine |
| InChI Key | VJROPLWGFCORRM-UHFFFAOYSA-N |
| Molecular Formula | C5H13N |
Myosmine, 98%, may contain up to 2% water
CAS: 532-12-7 Molecular Formula: C9H10N2 Molecular Weight (g/mol): 146.193 MDL Number: MFCD00052019 InChI Key: DPNGWXJMIILTBS-UHFFFAOYSA-N Synonym: myosmine,3-3,4-dihydro-2h-pyrrol-5-yl pyridine,3-1-pyrrolin-2-yl pyridine,miosmine,unii-9o0a545w4l,3-4,5-dihydro-3h-pyrrol-2-yl-pyridine,2-3-pyridyl-1-pyrroline,3-2-pyrrolin-2-yl pyridine,pyridine, 3-3,4-dihydro-2h-pyrrol-5-yl,pyridine, 3-1-pyrrolin-2-yl PubChem CID: 442649 ChEBI: CHEBI:7051 IUPAC Name: 3-(3,4-dihydro-2H-pyrrol-5-yl)pyridine SMILES: C1CC(=NC1)C2=CN=CC=C2
| PubChem CID | 442649 |
|---|---|
| CAS | 532-12-7 |
| Molecular Weight (g/mol) | 146.193 |
| ChEBI | CHEBI:7051 |
| MDL Number | MFCD00052019 |
| SMILES | C1CC(=NC1)C2=CN=CC=C2 |
| Synonym | myosmine,3-3,4-dihydro-2h-pyrrol-5-yl pyridine,3-1-pyrrolin-2-yl pyridine,miosmine,unii-9o0a545w4l,3-4,5-dihydro-3h-pyrrol-2-yl-pyridine,2-3-pyridyl-1-pyrroline,3-2-pyrrolin-2-yl pyridine,pyridine, 3-3,4-dihydro-2h-pyrrol-5-yl,pyridine, 3-1-pyrrolin-2-yl |
| IUPAC Name | 3-(3,4-dihydro-2H-pyrrol-5-yl)pyridine |
| InChI Key | DPNGWXJMIILTBS-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2 |
Isophorondiamine, 99+%, mixture of cis and trans
CAS: 2855-13-2 Molecular Formula: C10H22N2 Molecular Weight (g/mol): 170.30 MDL Number: MFCD00019397 InChI Key: RNLHGQLZWXBQNY-UHFFFAOYNA-N Synonym: isophorone diamine,isophoronediamine,3-aminomethyl-3,5,5-trimethylcyclohexylamine,3-aminomethyl-3,5,5-trimethylcyclohexanamine,cyclohexanemethanamine, 5-amino-1,3,3-trimethyl,ipda,ccris 6680,5-amino-1,3,3-trimethylcyclohexanemethylamine,cyclohexanemethylamine, 5-amino-1,3,3-trimethyl,1-amino-3-aminomethyl-3,5,5-trimethylcyclohexane PubChem CID: 17857 IUPAC Name: 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine SMILES: CC1(C)CC(N)CC(C)(CN)C1
| PubChem CID | 17857 |
|---|---|
| CAS | 2855-13-2 |
| Molecular Weight (g/mol) | 170.30 |
| MDL Number | MFCD00019397 |
| SMILES | CC1(C)CC(N)CC(C)(CN)C1 |
| Synonym | isophorone diamine,isophoronediamine,3-aminomethyl-3,5,5-trimethylcyclohexylamine,3-aminomethyl-3,5,5-trimethylcyclohexanamine,cyclohexanemethanamine, 5-amino-1,3,3-trimethyl,ipda,ccris 6680,5-amino-1,3,3-trimethylcyclohexanemethylamine,cyclohexanemethylamine, 5-amino-1,3,3-trimethyl,1-amino-3-aminomethyl-3,5,5-trimethylcyclohexane |
| IUPAC Name | 3-(aminomethyl)-3,5,5-trimethylcyclohexan-1-amine |
| InChI Key | RNLHGQLZWXBQNY-UHFFFAOYNA-N |
| Molecular Formula | C10H22N2 |
2-Aminoethanethiol, 95%
CAS: 60-23-1 Molecular Formula: C2H7NS Molecular Weight (g/mol): 77.15 MDL Number: MFCD00008196 InChI Key: UFULAYFCSOUIOV-UHFFFAOYSA-N Synonym: cysteamine,mercaptamine,thioethanolamine,becaptan,mercamine,cysteinamine,beta-mercaptoethylamine,2-mercaptoethylamine,cysteamin,lambraten PubChem CID: 6058 ChEBI: CHEBI:17141 IUPAC Name: 2-aminoethanethiol SMILES: NCCS
| PubChem CID | 6058 |
|---|---|
| CAS | 60-23-1 |
| Molecular Weight (g/mol) | 77.15 |
| ChEBI | CHEBI:17141 |
| MDL Number | MFCD00008196 |
| SMILES | NCCS |
| Synonym | cysteamine,mercaptamine,thioethanolamine,becaptan,mercamine,cysteinamine,beta-mercaptoethylamine,2-mercaptoethylamine,cysteamin,lambraten |
| IUPAC Name | 2-aminoethanethiol |
| InChI Key | UFULAYFCSOUIOV-UHFFFAOYSA-N |
| Molecular Formula | C2H7NS |
Cyclopropylamine, 98+%
CAS: 765-30-0 Molecular Formula: C3H7N Molecular Weight (g/mol): 57.096 MDL Number: MFCD00001301 InChI Key: HTJDQJBWANPRPF-UHFFFAOYSA-N Synonym: cyclopropylamine,aminocyclopropane,cyclopropyl amine,unii-8pr8xth1x1,8pr8xth1x1,cyclopropanamin,cyclopropyamine,cyclopropylamin,cylopropylamine,cycloproplyamine PubChem CID: 69828 ChEBI: CHEBI:34660 IUPAC Name: cyclopropanamine SMILES: C1CC1N
| PubChem CID | 69828 |
|---|---|
| CAS | 765-30-0 |
| Molecular Weight (g/mol) | 57.096 |
| ChEBI | CHEBI:34660 |
| MDL Number | MFCD00001301 |
| SMILES | C1CC1N |
| Synonym | cyclopropylamine,aminocyclopropane,cyclopropyl amine,unii-8pr8xth1x1,8pr8xth1x1,cyclopropanamin,cyclopropyamine,cyclopropylamin,cylopropylamine,cycloproplyamine |
| IUPAC Name | cyclopropanamine |
| InChI Key | HTJDQJBWANPRPF-UHFFFAOYSA-N |
| Molecular Formula | C3H7N |
Tetrahexylammonium Bromide, 99%
CAS: 4328-13-6 Molecular Formula: C24H52BrN Molecular Weight (g/mol): 434.59 MDL Number: MFCD00011858 InChI Key: SYZCZDCAEVUSPM-UHFFFAOYSA-M Synonym: tetrahexylammonium bromide,tetrahexylazanium bromide,tetra-n-hexylammonium bromide,1-hexanaminium, n,n,n-trihexyl-, bromide,1-hexanaminium, n,n,n-trihexyl-, bromide 1:1,n,n,n-trihexylhexan-1-aminiumbromide,acmc-209jtn,tetra-n-hexylammonium bromide 10g,1-hexanaminium,n,n,n-trihexyl-, bromide 1:1 PubChem CID: 78026 IUPAC Name: tetrahexylazanium;bromide SMILES: [Br-].CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC
| PubChem CID | 78026 |
|---|---|
| CAS | 4328-13-6 |
| Molecular Weight (g/mol) | 434.59 |
| MDL Number | MFCD00011858 |
| SMILES | [Br-].CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC |
| Synonym | tetrahexylammonium bromide,tetrahexylazanium bromide,tetra-n-hexylammonium bromide,1-hexanaminium, n,n,n-trihexyl-, bromide,1-hexanaminium, n,n,n-trihexyl-, bromide 1:1,n,n,n-trihexylhexan-1-aminiumbromide,acmc-209jtn,tetra-n-hexylammonium bromide 10g,1-hexanaminium,n,n,n-trihexyl-, bromide 1:1 |
| IUPAC Name | tetrahexylazanium;bromide |
| InChI Key | SYZCZDCAEVUSPM-UHFFFAOYSA-M |
| Molecular Formula | C24H52BrN |
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 |
4-Nitrophenyl isocyanate, 97%
CAS: 100-28-7 Molecular Formula: C7H4N2O3 Molecular Weight (g/mol): 164.12 MDL Number: MFCD00007306 InChI Key: GFNKTLQTQSALEJ-UHFFFAOYSA-N Synonym: 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 PubChem CID: 66012 IUPAC Name: 1-isocyanato-4-nitrobenzene SMILES: C1=CC(=CC=C1N=C=O)[N+](=O)[O-]
| PubChem CID | 66012 |
|---|---|
| CAS | 100-28-7 |
| Molecular Weight (g/mol) | 164.12 |
| MDL Number | MFCD00007306 |
| SMILES | C1=CC(=CC=C1N=C=O)[N+](=O)[O-] |
| Synonym | 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 |
| IUPAC Name | 1-isocyanato-4-nitrobenzene |
| InChI Key | GFNKTLQTQSALEJ-UHFFFAOYSA-N |
| Molecular Formula | C7H4N2O3 |
2-Ethylhexylamine, 99%
CAS: 104-75-6 Molecular Formula: C8H19N Molecular Weight (g/mol): 129.25 MDL Number: MFCD00008148 InChI Key: LTHNHFOGQMKPOV-UHFFFAOYSA-N Synonym: 2-ethylhexylamine,1-hexanamine, 2-ethyl,2-ethyl-1-hexylamine,2-ethyl hexylamine,2-ethylhexanamine,1-amino-2-ethylhexane,hexylamine, 2-ethyl,beta-ethylhexylamine,1-amino-2-ethylhexan,isooctylame PubChem CID: 7719 IUPAC Name: 2-ethylhexan-1-amine SMILES: CCCCC(CC)CN
| PubChem CID | 7719 |
|---|---|
| CAS | 104-75-6 |
| Molecular Weight (g/mol) | 129.25 |
| MDL Number | MFCD00008148 |
| SMILES | CCCCC(CC)CN |
| Synonym | 2-ethylhexylamine,1-hexanamine, 2-ethyl,2-ethyl-1-hexylamine,2-ethyl hexylamine,2-ethylhexanamine,1-amino-2-ethylhexane,hexylamine, 2-ethyl,beta-ethylhexylamine,1-amino-2-ethylhexan,isooctylame |
| IUPAC Name | 2-ethylhexan-1-amine |
| InChI Key | LTHNHFOGQMKPOV-UHFFFAOYSA-N |
| Molecular Formula | C8H19N |