Organoheterocyclic compounds
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2-Fluoropyridine, 98%
CAS: 372-48-5 Molecular Formula: C5H4FN Molecular Weight (g/mol): 97.09 MDL Number: MFCD00006224 InChI Key: MTAODLNXWYIKSO-UHFFFAOYSA-N Synonym: pyridine, 2-fluoro,o-fluoropyridine,2-fluoro-pyridine,pyridine, fluoro,ccris 1725,2-fluoranylpyridine,fluoropyridine,2fluoropyridine,2-fluorpyridin,2-fluoro-pyridinium PubChem CID: 9746 IUPAC Name: 2-fluoropyridine SMILES: C1=CC=NC(=C1)F
| PubChem CID | 9746 |
|---|---|
| CAS | 372-48-5 |
| Molecular Weight (g/mol) | 97.09 |
| MDL Number | MFCD00006224 |
| SMILES | C1=CC=NC(=C1)F |
| Synonym | pyridine, 2-fluoro,o-fluoropyridine,2-fluoro-pyridine,pyridine, fluoro,ccris 1725,2-fluoranylpyridine,fluoropyridine,2fluoropyridine,2-fluorpyridin,2-fluoro-pyridinium |
| IUPAC Name | 2-fluoropyridine |
| InChI Key | MTAODLNXWYIKSO-UHFFFAOYSA-N |
| Molecular Formula | C5H4FN |
1-Ethyl-3-methylimidazolium tetrafluoroborate, 98+% (dry wt.), may cont. up to 3% water
CAS: 143314-16-3 Molecular Formula: C6H11BF4N2 Molecular Weight (g/mol): 197.97 MDL Number: MFCD00216668 InChI Key: CUNYTRQQXKCRTJ-UHFFFAOYSA-N Synonym: 1-ethyl-3-methylimidazolium tetrafluoroborate,1-ethyl-3-methyl-1h-imidazol-3-ium tetrafluoroborate,emimbf4,basionics™ ee 03,acmc-209cq9,dsstox_cid_29074,dsstox_rid_83293,dsstox_gsid_49218,ksc174g8n,1-methyl-3-ethylimidazolium tetrafluoroborate PubChem CID: 2769348 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;tetrafluoroborate SMILES: F[B-](F)(F)F.CCN1C=C[N+](C)=C1
| PubChem CID | 2769348 |
|---|---|
| CAS | 143314-16-3 |
| Molecular Weight (g/mol) | 197.97 |
| MDL Number | MFCD00216668 |
| SMILES | F[B-](F)(F)F.CCN1C=C[N+](C)=C1 |
| Synonym | 1-ethyl-3-methylimidazolium tetrafluoroborate,1-ethyl-3-methyl-1h-imidazol-3-ium tetrafluoroborate,emimbf4,basionics™ ee 03,acmc-209cq9,dsstox_cid_29074,dsstox_rid_83293,dsstox_gsid_49218,ksc174g8n,1-methyl-3-ethylimidazolium tetrafluoroborate |
| IUPAC Name | 1-ethyl-3-methylimidazol-3-ium;tetrafluoroborate |
| InChI Key | CUNYTRQQXKCRTJ-UHFFFAOYSA-N |
| Molecular Formula | C6H11BF4N2 |
1-Ethyl-3-methylimidazolium bromide, 98+%
CAS: 65039-08-9 Molecular Formula: C6H11BrN2 Molecular Weight (g/mol): 191.07 MDL Number: MFCD03427610 InChI Key: GWQYPLXGJIXMMV-UHFFFAOYSA-M Synonym: 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br PubChem CID: 2734235 IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;bromide SMILES: [Br-].CCN1C=C[N+](C)=C1
| PubChem CID | 2734235 |
|---|---|
| CAS | 65039-08-9 |
| Molecular Weight (g/mol) | 191.07 |
| MDL Number | MFCD03427610 |
| SMILES | [Br-].CCN1C=C[N+](C)=C1 |
| Synonym | 1-ethyl-3-methylimidazolium bromide,3-ethyl-1-methyl-1h-imidazol-3-ium bromide,1-ethyl-3-methylmidazolium bromide,unii-xo254ye73i,1-ethyl-3-methyl-1h-imidazol-3-ium bromide,acmc-1b3a0,dsstox_cid_29300,dsstox_rid_83418,dsstox_gsid_49343,c6h11n2.br |
| IUPAC Name | 1-ethyl-3-methylimidazol-3-ium;bromide |
| InChI Key | GWQYPLXGJIXMMV-UHFFFAOYSA-M |
| Molecular Formula | C6H11BrN2 |
Nickel phthalocyanine, 95%
CAS: 14055-02-8 Molecular Formula: C32H16N8Ni Molecular Weight (g/mol): 571.23 MDL Number: MFCD00041954 InChI Key: LVIYYTJTOKJJOC-UHFFFAOYSA-N Synonym: nickel phthalocyanine,nickel ii phthalocyanine,phthalocyanine, ni,nickel ii phthalocyanine, dye content 85 % PubChem CID: 2735100 IUPAC Name: nickel(2+) 2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1³,¹⁰.1¹²,¹⁹.1²¹,²⁸.0⁴,⁹.0¹³,¹⁸.0²²,²⁷.0³¹,³⁶]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19,21(38),22,24,26,28,30,32,34-nonadecaene-37,39-diide SMILES: [Ni++].[N-]1C2=NC3=NC(=NC4=C5C=CC=CC5=C([N-]4)N=C4N=C(N=C1C1=CC=CC=C21)C1=CC=CC=C41)C1=CC=CC=C31
| PubChem CID | 2735100 |
|---|---|
| CAS | 14055-02-8 |
| Molecular Weight (g/mol) | 571.23 |
| MDL Number | MFCD00041954 |
| SMILES | [Ni++].[N-]1C2=NC3=NC(=NC4=C5C=CC=CC5=C([N-]4)N=C4N=C(N=C1C1=CC=CC=C21)C1=CC=CC=C41)C1=CC=CC=C31 |
| Synonym | nickel phthalocyanine,nickel ii phthalocyanine,phthalocyanine, ni,nickel ii phthalocyanine, dye content 85 % |
| IUPAC Name | nickel(2+) 2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1³,¹⁰.1¹²,¹⁹.1²¹,²⁸.0⁴,⁹.0¹³,¹⁸.0²²,²⁷.0³¹,³⁶]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19,21(38),22,24,26,28,30,32,34-nonadecaene-37,39-diide |
| InChI Key | LVIYYTJTOKJJOC-UHFFFAOYSA-N |
| Molecular Formula | C32H16N8Ni |
p-Dithiane-2,5-diol, 96%
CAS: 40018-26-6 Molecular Formula: C4H8O2S2 Molecular Weight (g/mol): 152.23 InChI Key: YUIOPHXTILULQC-UHFFFAOYSA-N Synonym: p-dithiane-2,5-diol,2,5-dihydroxy-1,4-dithiane,mercaptoacetaldehyde dimer,4-dithiane-2,5-diol,1,4 dithiane-2,5-diol,2,5-dihydroxy-1,4-dithian,p-dthane-2,5-dol,pubchem20480,1,4dithiane-2,5diol,acmc-1anme PubChem CID: 98330 IUPAC Name: 1,4-dithiane-2,5-diol SMILES: C1C(SCC(S1)O)O
| PubChem CID | 98330 |
|---|---|
| CAS | 40018-26-6 |
| Molecular Weight (g/mol) | 152.23 |
| SMILES | C1C(SCC(S1)O)O |
| Synonym | p-dithiane-2,5-diol,2,5-dihydroxy-1,4-dithiane,mercaptoacetaldehyde dimer,4-dithiane-2,5-diol,1,4 dithiane-2,5-diol,2,5-dihydroxy-1,4-dithian,p-dthane-2,5-dol,pubchem20480,1,4dithiane-2,5diol,acmc-1anme |
| IUPAC Name | 1,4-dithiane-2,5-diol |
| InChI Key | YUIOPHXTILULQC-UHFFFAOYSA-N |
| Molecular Formula | C4H8O2S2 |
1,1'-(Azodicarbonyl)dipiperidine, 97%
CAS: 10465-81-3 Molecular Formula: C12H20N4O2 Molecular Weight (g/mol): 252.32 MDL Number: MFCD00010111 InChI Key: OQJBFFCUFALWQL-UHFFFAOYSA-N Synonym: 1,1'-azodicarbonyl-dipiperidine,1,1-azodicarbonyl dipiperidine,1,1'-azodicarbonyl dipiperidine,addp,diazene-1,2-diylbis piperidin-1-ylmethanone,azodicarboxylic acid dipiperidine,ne-n-piperidine-1-carbonylimino piperidine-1-carboxamide,1,1'-azodicarbonyl dipiperidine addp,piperidyl piperidylcarbonyl diazenyl ketone,e-diazene-1,2-diylbis piperidin-1-ylmethanone PubChem CID: 5702657 IUPAC Name: (NE)-N-(piperidine-1-carbonylimino)piperidine-1-carboxamide SMILES: O=C(N=NC(=O)N1CCCCC1)N1CCCCC1
| PubChem CID | 5702657 |
|---|---|
| CAS | 10465-81-3 |
| Molecular Weight (g/mol) | 252.32 |
| MDL Number | MFCD00010111 |
| SMILES | O=C(N=NC(=O)N1CCCCC1)N1CCCCC1 |
| Synonym | 1,1'-azodicarbonyl-dipiperidine,1,1-azodicarbonyl dipiperidine,1,1'-azodicarbonyl dipiperidine,addp,diazene-1,2-diylbis piperidin-1-ylmethanone,azodicarboxylic acid dipiperidine,ne-n-piperidine-1-carbonylimino piperidine-1-carboxamide,1,1'-azodicarbonyl dipiperidine addp,piperidyl piperidylcarbonyl diazenyl ketone,e-diazene-1,2-diylbis piperidin-1-ylmethanone |
| IUPAC Name | (NE)-N-(piperidine-1-carbonylimino)piperidine-1-carboxamide |
| InChI Key | OQJBFFCUFALWQL-UHFFFAOYSA-N |
| Molecular Formula | C12H20N4O2 |
1-Boc-5-bromoindoline, 97%
CAS: 261732-38-1 Molecular Formula: C13H16BrNO2 Molecular Weight (g/mol): 298.18 MDL Number: MFCD08059280 InChI Key: UOCVSZYBRMGQOL-UHFFFAOYSA-N Synonym: tert-butyl 5-bromoindoline-1-carboxylate,1-boc-5-bromoindoline,n-boc-5-bromoindoline,tert-butyl 5-bromo-2,3-dihydro-1h-indole-1-carboxylate,5-bromo-2,3-dihydro-indole-1-carboxylic acid tert-butyl ester,1h-indole-1-carboxylic acid, 5-bromo-2,3-dihydro-, 1,1-dimethylethyl ester,acmc-20aixt,amth084,5-bromo-1-t-butyloxycarbonylindoline PubChem CID: 21865438 IUPAC Name: tert-butyl 5-bromo-2,3-dihydroindole-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC2=C1C=CC(=C2)Br
| PubChem CID | 21865438 |
|---|---|
| CAS | 261732-38-1 |
| Molecular Weight (g/mol) | 298.18 |
| MDL Number | MFCD08059280 |
| SMILES | CC(C)(C)OC(=O)N1CCC2=C1C=CC(=C2)Br |
| Synonym | tert-butyl 5-bromoindoline-1-carboxylate,1-boc-5-bromoindoline,n-boc-5-bromoindoline,tert-butyl 5-bromo-2,3-dihydro-1h-indole-1-carboxylate,5-bromo-2,3-dihydro-indole-1-carboxylic acid tert-butyl ester,1h-indole-1-carboxylic acid, 5-bromo-2,3-dihydro-, 1,1-dimethylethyl ester,acmc-20aixt,amth084,5-bromo-1-t-butyloxycarbonylindoline |
| IUPAC Name | tert-butyl 5-bromo-2,3-dihydroindole-1-carboxylate |
| InChI Key | UOCVSZYBRMGQOL-UHFFFAOYSA-N |
| Molecular Formula | C13H16BrNO2 |
4-Amino-3-chloropyridine, 97%
CAS: 19798-77-7 Molecular Formula: C5H5ClN2 Molecular Weight (g/mol): 128.559 MDL Number: MFCD03984473 InChI Key: KJBKPRMEMJKXDV-UHFFFAOYSA-N Synonym: 4-amino-3-chloropyridine,3-chloro-pyridin-4-ylamine,3-chloro-4-pyridinamine,3-chloro-4-aminopyridine,3-chloro-4-pyridinylamine,4-pyridinamine, 3-chloro,3-chloro-4-pyridinamin,3-chloro-4-pyridylamine,4-amino-3-chloro-pyridine,pubchem6653 PubChem CID: 581853 IUPAC Name: 3-chloropyridin-4-amine SMILES: C1=CN=CC(=C1N)Cl
| PubChem CID | 581853 |
|---|---|
| CAS | 19798-77-7 |
| Molecular Weight (g/mol) | 128.559 |
| MDL Number | MFCD03984473 |
| SMILES | C1=CN=CC(=C1N)Cl |
| Synonym | 4-amino-3-chloropyridine,3-chloro-pyridin-4-ylamine,3-chloro-4-pyridinamine,3-chloro-4-aminopyridine,3-chloro-4-pyridinylamine,4-pyridinamine, 3-chloro,3-chloro-4-pyridinamin,3-chloro-4-pyridylamine,4-amino-3-chloro-pyridine,pubchem6653 |
| IUPAC Name | 3-chloropyridin-4-amine |
| InChI Key | KJBKPRMEMJKXDV-UHFFFAOYSA-N |
| Molecular Formula | C5H5ClN2 |
3-(Methylamino)oxetane, 95%
CAS: 952182-03-5 Molecular Formula: C4H9NO Molecular Weight (g/mol): 87.122 MDL Number: MFCD08544349 InChI Key: JUIXJPRSYHSLHK-UHFFFAOYSA-N Synonym: n-methyl-3-oxetanamine,1-methyl-3-oxetanamine,3-methylamino oxetane,n-methyl-3-oxetaneamine,3-methylaminooxetane,n-methyloxetane-3-amine,3-oxetanamine,n-methyl,n-methyl-3-aminooxetane,3-oxetanamine, n-methyl PubChem CID: 46839993 IUPAC Name: N-methyloxetan-3-amine SMILES: CNC1COC1
| PubChem CID | 46839993 |
|---|---|
| CAS | 952182-03-5 |
| Molecular Weight (g/mol) | 87.122 |
| MDL Number | MFCD08544349 |
| SMILES | CNC1COC1 |
| Synonym | n-methyl-3-oxetanamine,1-methyl-3-oxetanamine,3-methylamino oxetane,n-methyl-3-oxetaneamine,3-methylaminooxetane,n-methyloxetane-3-amine,3-oxetanamine,n-methyl,n-methyl-3-aminooxetane,3-oxetanamine, n-methyl |
| IUPAC Name | N-methyloxetan-3-amine |
| InChI Key | JUIXJPRSYHSLHK-UHFFFAOYSA-N |
| Molecular Formula | C4H9NO |
Furo[3,2-b]pyridine, 95%
CAS: 272-62-8 Molecular Formula: C7H5NO Molecular Weight (g/mol): 119.12 MDL Number: MFCD11870744 InChI Key: YRTCKZIKGWZNCU-UHFFFAOYSA-N Synonym: furo 3,2-b pyridine,4-azabenzo b furan,furopyridine,furo 3,2-b pyridin,4-aza-1-benzofuran PubChem CID: 12210217 IUPAC Name: furo[3,2-b]pyridine SMILES: O1C=CC2=NC=CC=C12
| PubChem CID | 12210217 |
|---|---|
| CAS | 272-62-8 |
| Molecular Weight (g/mol) | 119.12 |
| MDL Number | MFCD11870744 |
| SMILES | O1C=CC2=NC=CC=C12 |
| Synonym | furo 3,2-b pyridine,4-azabenzo b furan,furopyridine,furo 3,2-b pyridin,4-aza-1-benzofuran |
| IUPAC Name | furo[3,2-b]pyridine |
| InChI Key | YRTCKZIKGWZNCU-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO |
4-Methyl-5-vinylthiazole, 98+%
CAS: 1759-28-0 Molecular Formula: C6H7NS Molecular Weight (g/mol): 125.19 MDL Number: MFCD00005337 InChI Key: QUAMMXIRDIIGDJ-UHFFFAOYSA-N Synonym: 4-methyl-5-vinylthiazole,thiazole, 5-ethenyl-4-methyl,4-methyl-5-vinyl thiazole,5-ethenyl-4-methylthiazole,thiazole, 4-methyl-5-vinyl,vinylsulfurol,vinyl sulfurol,fema no. 3313,5-vinyl-4-methylthiazole,4-methyl-5-vinyl-thiazole PubChem CID: 15654 IUPAC Name: 5-ethenyl-4-methyl-1,3-thiazole SMILES: CC1=C(SC=N1)C=C
| PubChem CID | 15654 |
|---|---|
| CAS | 1759-28-0 |
| Molecular Weight (g/mol) | 125.19 |
| MDL Number | MFCD00005337 |
| SMILES | CC1=C(SC=N1)C=C |
| Synonym | 4-methyl-5-vinylthiazole,thiazole, 5-ethenyl-4-methyl,4-methyl-5-vinyl thiazole,5-ethenyl-4-methylthiazole,thiazole, 4-methyl-5-vinyl,vinylsulfurol,vinyl sulfurol,fema no. 3313,5-vinyl-4-methylthiazole,4-methyl-5-vinyl-thiazole |
| IUPAC Name | 5-ethenyl-4-methyl-1,3-thiazole |
| InChI Key | QUAMMXIRDIIGDJ-UHFFFAOYSA-N |
| Molecular Formula | C6H7NS |
Indole-3-acetic acid, 98+%
CAS: 87-51-4 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00005636 InChI Key: SEOVTRFCIGRIMH-UHFFFAOYSA-N Synonym: indole-3-acetic acid,3-indoleacetic acid,heteroauxin,indoleacetic acid,1h-indole-3-acetic acid,2-1h-indol-3-yl acetic acid,rhizopin,1h-indol-3-ylacetic acid,indol-3-ylacetic acid,rhizopon a PubChem CID: 802 ChEBI: CHEBI:16411 IUPAC Name: 2-(1H-indol-3-yl)acetic acid SMILES: OC(=O)CC1=CNC2=CC=CC=C12
| PubChem CID | 802 |
|---|---|
| CAS | 87-51-4 |
| Molecular Weight (g/mol) | 175.19 |
| ChEBI | CHEBI:16411 |
| MDL Number | MFCD00005636 |
| SMILES | OC(=O)CC1=CNC2=CC=CC=C12 |
| Synonym | indole-3-acetic acid,3-indoleacetic acid,heteroauxin,indoleacetic acid,1h-indole-3-acetic acid,2-1h-indol-3-yl acetic acid,rhizopin,1h-indol-3-ylacetic acid,indol-3-ylacetic acid,rhizopon a |
| IUPAC Name | 2-(1H-indol-3-yl)acetic acid |
| InChI Key | SEOVTRFCIGRIMH-UHFFFAOYSA-N |
| Molecular Formula | C10H9NO2 |
Thermo Scientific Chemicals Succinimidyl acetate
CAS: 14464-29-0 Molecular Formula: C6H7NO4 Molecular Weight (g/mol): 157.13 InChI Key: SIFCHNIAAPMMKG-UHFFFAOYSA-N IUPAC Name: 2,5-dioxopyrrolidin-1-yl acetate SMILES: CC(=O)ON1C(=O)CCC1=O
| CAS | 14464-29-0 |
|---|---|
| Molecular Weight (g/mol) | 157.13 |
| SMILES | CC(=O)ON1C(=O)CCC1=O |
| IUPAC Name | 2,5-dioxopyrrolidin-1-yl acetate |
| InChI Key | SIFCHNIAAPMMKG-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO4 |
4-Thiouracil, 97%, Thermo Scientific Chemicals
CAS: 591-28-6 Molecular Formula: C4H4N2OS Molecular Weight (g/mol): 128.15 MDL Number: MFCD00090842 InChI Key: OVONXEQGWXGFJD-UHFFFAOYSA-N Synonym: 4-thiouracil,2-hydroxy-4 1h-pyrimidinethione,4-thioxo-3,4-dihydropyrimidin-2 1h-one,2-hydroxy-4-mercaptopyrimidine,uracil, 4-thio,4-mercaptopyrimidin-2-ol,4-sulfanylpyrimidin-2-ol,2-hydroxy-4-thiopyrimidine,2 1h-pyrimidinone, 3,4-dihydro-4-thioxo,2 1h-pyrimidinone, 4-mercapto-9ci PubChem CID: 2734394 IUPAC Name: 4-sulfanylidene-1,2,3,4-tetrahydropyrimidin-2-one SMILES: O=C1NC=CC(=S)N1
| PubChem CID | 2734394 |
|---|---|
| CAS | 591-28-6 |
| Molecular Weight (g/mol) | 128.15 |
| MDL Number | MFCD00090842 |
| SMILES | O=C1NC=CC(=S)N1 |
| Synonym | 4-thiouracil,2-hydroxy-4 1h-pyrimidinethione,4-thioxo-3,4-dihydropyrimidin-2 1h-one,2-hydroxy-4-mercaptopyrimidine,uracil, 4-thio,4-mercaptopyrimidin-2-ol,4-sulfanylpyrimidin-2-ol,2-hydroxy-4-thiopyrimidine,2 1h-pyrimidinone, 3,4-dihydro-4-thioxo,2 1h-pyrimidinone, 4-mercapto-9ci |
| IUPAC Name | 4-sulfanylidene-1,2,3,4-tetrahydropyrimidin-2-one |
| InChI Key | OVONXEQGWXGFJD-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2OS |
3-Bromofuro[3,2-b]pyridine, 96%
CAS: 92404-63-2 Molecular Formula: C7H4BrNO Molecular Weight (g/mol): 198.019 MDL Number: MFCD19687763 InChI Key: KHMAAFDMZSYVEF-UHFFFAOYSA-N Synonym: 3-bromofuro 3,2-b pyridine,furo 3,2-b pyridine, 3-bromo,acmc-20lvu1 PubChem CID: 641477 IUPAC Name: 3-bromofuro[3,2-b]pyridine SMILES: C1=CC2=C(C(=CO2)Br)N=C1
| PubChem CID | 641477 |
|---|---|
| CAS | 92404-63-2 |
| Molecular Weight (g/mol) | 198.019 |
| MDL Number | MFCD19687763 |
| SMILES | C1=CC2=C(C(=CO2)Br)N=C1 |
| Synonym | 3-bromofuro 3,2-b pyridine,furo 3,2-b pyridine, 3-bromo,acmc-20lvu1 |
| IUPAC Name | 3-bromofuro[3,2-b]pyridine |
| InChI Key | KHMAAFDMZSYVEF-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrNO |