Organoheterocyclic compounds
Filtered Search Results
5-Methyl-2-phenyl-1,3-oxazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 18735-74-5 Molecular Formula: C11H8NO3 Molecular Weight (g/mol): 202.19 MDL Number: MFCD00275475 InChI Key: YABCPNYCFFUVNM-UHFFFAOYSA-M Synonym: 5-methyl-2-phenyloxazole-4-carboxylic acid,2-phenyl-5-methyloxazole-4-carboxylic acid,5-methyl-2-phenyl-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 5-methyl-2-phenyl,5-methyl-2-phenyloxazole-4-carboxylicacid,4-carboxy-5-methyl-2-phenyl-1,3-oxazole,4-oxazolecarboxylicacid,5-methyl-2-phenyl,2-phenyl-5-methyl-oxazole-4-carboxylic acid,4-oxazolecarboxylicacid, 5-methyl-2-phenyl,5-methyl-2-phenyloxazol-4-ylcarboxylic acid PubChem CID: 318533 IUPAC Name: 5-methyl-2-phenyl-1,3-oxazole-4-carboxylic acid SMILES: CC1=C(N=C(O1)C1=CC=CC=C1)C([O-])=O
| PubChem CID | 318533 |
|---|---|
| CAS | 18735-74-5 |
| Molecular Weight (g/mol) | 202.19 |
| MDL Number | MFCD00275475 |
| SMILES | CC1=C(N=C(O1)C1=CC=CC=C1)C([O-])=O |
| Synonym | 5-methyl-2-phenyloxazole-4-carboxylic acid,2-phenyl-5-methyloxazole-4-carboxylic acid,5-methyl-2-phenyl-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 5-methyl-2-phenyl,5-methyl-2-phenyloxazole-4-carboxylicacid,4-carboxy-5-methyl-2-phenyl-1,3-oxazole,4-oxazolecarboxylicacid,5-methyl-2-phenyl,2-phenyl-5-methyl-oxazole-4-carboxylic acid,4-oxazolecarboxylicacid, 5-methyl-2-phenyl,5-methyl-2-phenyloxazol-4-ylcarboxylic acid |
| IUPAC Name | 5-methyl-2-phenyl-1,3-oxazole-4-carboxylic acid |
| InChI Key | YABCPNYCFFUVNM-UHFFFAOYSA-M |
| Molecular Formula | C11H8NO3 |
4-(1,3-Oxazol-5-yl)aniline, 97%, Thermo Scientific™
CAS: 1008-95-3 Molecular Formula: C9H8N2O Molecular Weight (g/mol): 160.176 MDL Number: MFCD00052192 InChI Key: SLJBMRSOKUTXDF-UHFFFAOYSA-N PubChem CID: 517747 IUPAC Name: 4-(1,3-oxazol-5-yl)aniline SMILES: C1=CC(=CC=C1C2=CN=CO2)N
| PubChem CID | 517747 |
|---|---|
| CAS | 1008-95-3 |
| Molecular Weight (g/mol) | 160.176 |
| MDL Number | MFCD00052192 |
| SMILES | C1=CC(=CC=C1C2=CN=CO2)N |
| IUPAC Name | 4-(1,3-oxazol-5-yl)aniline |
| InChI Key | SLJBMRSOKUTXDF-UHFFFAOYSA-N |
| Molecular Formula | C9H8N2O |
2,5-Dimethyl-1,3-oxazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 23000-14-8 Molecular Formula: C6H7NO3 Molecular Weight (g/mol): 141.126 MDL Number: MFCD03011595 InChI Key: LHGRUGVXZLHYKE-UHFFFAOYSA-N Synonym: 2,5-dimethyloxazole-4-carboxylic acid,dimethyl-1,3-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2,5-dimethyl,2,5-dimethyl-1,3-oxazole-4-carboxylicacid,4-carboxy-2,5-dimethyl-1,3-oxazole,2,5-dimethyl-oxazole-4-carboxylic acid,2.5-dimethyl-1,3-oxazole-4-carboxylic acid PubChem CID: 2795465 IUPAC Name: 2,5-dimethyl-1,3-oxazole-4-carboxylic acid SMILES: CC1=C(N=C(O1)C)C(=O)O
| PubChem CID | 2795465 |
|---|---|
| CAS | 23000-14-8 |
| Molecular Weight (g/mol) | 141.126 |
| MDL Number | MFCD03011595 |
| SMILES | CC1=C(N=C(O1)C)C(=O)O |
| Synonym | 2,5-dimethyloxazole-4-carboxylic acid,dimethyl-1,3-oxazole-4-carboxylic acid,4-oxazolecarboxylic acid, 2,5-dimethyl,2,5-dimethyl-1,3-oxazole-4-carboxylicacid,4-carboxy-2,5-dimethyl-1,3-oxazole,2,5-dimethyl-oxazole-4-carboxylic acid,2.5-dimethyl-1,3-oxazole-4-carboxylic acid |
| IUPAC Name | 2,5-dimethyl-1,3-oxazole-4-carboxylic acid |
| InChI Key | LHGRUGVXZLHYKE-UHFFFAOYSA-N |
| Molecular Formula | C6H7NO3 |
1,3-Benzodioxol-5-ylmethyl isothiocyanate, ≥95%, Thermo Scientific™
CAS: 4430-47-1 Molecular Formula: C9H7NO2S Molecular Weight (g/mol): 193.22 MDL Number: MFCD00041217 InChI Key: PUJWRDBPAFJUJW-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy benzyl isothiocyanate,1,3-benzodioxol-5-ylmethyl isothiocyanate,5-isothiocyanatomethyl-1,3-benzodioxole,3,4-methylenedioxybenzyl isothiocyanate,5-isothiocyanatomethyl-2h-1,3-benzodioxole,5-isothiocyanatomethyl-benzo 1,3 dioxole,5-isothiocyanatomethyl benzo d 1,3 dioxole,acmc-20angn,pubchem9883,akos bbr-002798 PubChem CID: 2795371 IUPAC Name: 5-(isothiocyanatomethyl)-1,3-benzodioxole SMILES: S=C=NCC1=CC=C2OCOC2=C1
| PubChem CID | 2795371 |
|---|---|
| CAS | 4430-47-1 |
| Molecular Weight (g/mol) | 193.22 |
| MDL Number | MFCD00041217 |
| SMILES | S=C=NCC1=CC=C2OCOC2=C1 |
| Synonym | 3,4-methylenedioxy benzyl isothiocyanate,1,3-benzodioxol-5-ylmethyl isothiocyanate,5-isothiocyanatomethyl-1,3-benzodioxole,3,4-methylenedioxybenzyl isothiocyanate,5-isothiocyanatomethyl-2h-1,3-benzodioxole,5-isothiocyanatomethyl-benzo 1,3 dioxole,5-isothiocyanatomethyl benzo d 1,3 dioxole,acmc-20angn,pubchem9883,akos bbr-002798 |
| IUPAC Name | 5-(isothiocyanatomethyl)-1,3-benzodioxole |
| InChI Key | PUJWRDBPAFJUJW-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO2S |
1-(1,3-Benzodioxol-5-yl)-2-bromoethan-1-one, Thermo Scientific™
CAS: 40288-65-1 Molecular Formula: C9H7BrO3 Molecular Weight (g/mol): 243.056 InChI Key: QBXCVQVFPVXAGS-UHFFFAOYSA-N PubChem CID: 243777 IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-bromoethanone SMILES: C1OC2=C(O1)C=C(C=C2)C(=O)CBr
| PubChem CID | 243777 |
|---|---|
| CAS | 40288-65-1 |
| Molecular Weight (g/mol) | 243.056 |
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)CBr |
| IUPAC Name | 1-(1,3-benzodioxol-5-yl)-2-bromoethanone |
| InChI Key | QBXCVQVFPVXAGS-UHFFFAOYSA-N |
| Molecular Formula | C9H7BrO3 |
2-(1,3-Benzodioxol-5-yl)ethanol, ≥97%, Thermo Scientific™
CAS: 6006-82-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00666033 InChI Key: JADSGOFBFPTCHG-UHFFFAOYSA-N Synonym: 2-benzo d 1,3 dioxol-5-yl ethanol,2-2h-1,3-benzodioxol-5-yl ethan-1-ol,3,4-methylenedioxy phenethyl alcohol,2-1,3-benzodioxol-5-yl ethanol,1,3-benzodioxole-5-ethanol,homopiperonyl alcohol,3,4-methylenedioxyphenethyl alcohol,2-1,3-benzodioxol-5-yl-ethanol,2-2h-1,3-benzodioxol-5-yl ethanol,benzodioxolylethanol PubChem CID: 2759846 IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethanol SMILES: C1OC2=C(O1)C=C(C=C2)CCO
| PubChem CID | 2759846 |
|---|---|
| CAS | 6006-82-2 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00666033 |
| SMILES | C1OC2=C(O1)C=C(C=C2)CCO |
| Synonym | 2-benzo d 1,3 dioxol-5-yl ethanol,2-2h-1,3-benzodioxol-5-yl ethan-1-ol,3,4-methylenedioxy phenethyl alcohol,2-1,3-benzodioxol-5-yl ethanol,1,3-benzodioxole-5-ethanol,homopiperonyl alcohol,3,4-methylenedioxyphenethyl alcohol,2-1,3-benzodioxol-5-yl-ethanol,2-2h-1,3-benzodioxol-5-yl ethanol,benzodioxolylethanol |
| IUPAC Name | 2-(1,3-benzodioxol-5-yl)ethanol |
| InChI Key | JADSGOFBFPTCHG-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Tetrahydrofuran-3-sulfonyl chloride, Thermo Scientific™
CAS: 1207346-29-9 Molecular Formula: C4H7ClO3S Molecular Weight (g/mol): 170.607 InChI Key: MVZIUOJNVVIOEY-UHFFFAOYSA-N Synonym: tetrahydrofuran-3-sulfonyl chloride,chlorooxolan-3-ylsulfone PubChem CID: 49762850 IUPAC Name: oxolane-3-sulfonyl chloride SMILES: C1COCC1S(=O)(=O)Cl
| PubChem CID | 49762850 |
|---|---|
| CAS | 1207346-29-9 |
| Molecular Weight (g/mol) | 170.607 |
| SMILES | C1COCC1S(=O)(=O)Cl |
| Synonym | tetrahydrofuran-3-sulfonyl chloride,chlorooxolan-3-ylsulfone |
| IUPAC Name | oxolane-3-sulfonyl chloride |
| InChI Key | MVZIUOJNVVIOEY-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO3S |
Tetrahydrothiopyran-4-ylmethanol, 97%, Thermo Scientific™
CAS: 100277-27-8 Molecular Formula: C6H12OS Molecular Weight (g/mol): 132.221 MDL Number: MFCD09966150 InChI Key: LMVCLDAMMNHILO-UHFFFAOYSA-N Synonym: tetrahydro-2h-thiopyran-4-yl methanol,tetrahydrothiopyran-4-methanol,tetrahydrothiopyran-4-ylmethanol,thian-4-yl methanol,2h-thiopyran-4-methanol, tetrahydro,2h-thiopyran-4-methanol,tetrahydro,4-hydroxymethyl tetrahydro-2h-thiopyran,acmc-20dmhk,thian-4-ylmethan-1-ol,4-hydroxymethyl thiane PubChem CID: 20143654 IUPAC Name: thian-4-ylmethanol SMILES: C1CSCCC1CO
| PubChem CID | 20143654 |
|---|---|
| CAS | 100277-27-8 |
| Molecular Weight (g/mol) | 132.221 |
| MDL Number | MFCD09966150 |
| SMILES | C1CSCCC1CO |
| Synonym | tetrahydro-2h-thiopyran-4-yl methanol,tetrahydrothiopyran-4-methanol,tetrahydrothiopyran-4-ylmethanol,thian-4-yl methanol,2h-thiopyran-4-methanol, tetrahydro,2h-thiopyran-4-methanol,tetrahydro,4-hydroxymethyl tetrahydro-2h-thiopyran,acmc-20dmhk,thian-4-ylmethan-1-ol,4-hydroxymethyl thiane |
| IUPAC Name | thian-4-ylmethanol |
| InChI Key | LMVCLDAMMNHILO-UHFFFAOYSA-N |
| Molecular Formula | C6H12OS |
2-Heptadecylimidazole, Spectrum™ Chemical
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CAS: 23328-87-2
| CAS | 23328-87-2 |
|---|
5-Methyl-2-(trifluoromethyl)-3-furyl isocyanate, 97%, Thermo Scientific™
CAS: 306935-03-5 Molecular Formula: C7H4F3NO2 Molecular Weight (g/mol): 191.109 InChI Key: WTKWFNIIIXNTDO-UHFFFAOYSA-N Synonym: 5-methyl-2-trifluoromethyl-3-furyl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl furan,furan,3-isocyanato-5-methyl-2-trifluoromethyl,5-methyl-2-trifluoromethyl fur-3-yl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl-furan,5-methyl-2-trifluoromethyl-3-furylisocyanate,5-methyl-2-trifluoromethyl furan-3-isocyanate,furan, 3-isocyanato-5-methyl-2-trifluoromethyl-9ci PubChem CID: 2779896 IUPAC Name: 3-isocyanato-5-methyl-2-(trifluoromethyl)furan SMILES: CC1=CC(=C(O1)C(F)(F)F)N=C=O
| PubChem CID | 2779896 |
|---|---|
| CAS | 306935-03-5 |
| Molecular Weight (g/mol) | 191.109 |
| SMILES | CC1=CC(=C(O1)C(F)(F)F)N=C=O |
| Synonym | 5-methyl-2-trifluoromethyl-3-furyl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl furan,furan,3-isocyanato-5-methyl-2-trifluoromethyl,5-methyl-2-trifluoromethyl fur-3-yl isocyanate,3-isocyanato-5-methyl-2-trifluoromethyl-furan,5-methyl-2-trifluoromethyl-3-furylisocyanate,5-methyl-2-trifluoromethyl furan-3-isocyanate,furan, 3-isocyanato-5-methyl-2-trifluoromethyl-9ci |
| IUPAC Name | 3-isocyanato-5-methyl-2-(trifluoromethyl)furan |
| InChI Key | WTKWFNIIIXNTDO-UHFFFAOYSA-N |
| Molecular Formula | C7H4F3NO2 |
4-(3,5-Dimethyl-1H-pyrazol-1-yl)benzonitrile, 97%, Thermo Scientific™
CAS: 56935-79-6 Molecular Formula: C12H11N3 Molecular Weight (g/mol): 197.241 MDL Number: MFCD09817559 InChI Key: BTXLPDNFEZIQBZ-UHFFFAOYSA-N Synonym: 4-3,5-dimethyl-1h-pyrazol-1-yl benzonitrile,4-3,5-dimethylpyrazol-1-yl benzonitrile,acmc-209luz,4-3,5-dimethylpyrazol-1-yl-benzonitrile,4-3,5-dimethylpyrazolyl benzenecarbonitrile,1-4-cyanophenyl-3,5-dimethyl-1h-pyrazole,benzonitrile, 4-3,5-dimethyl-1h-pyrazol-1-yl PubChem CID: 15005387 IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)benzonitrile SMILES: CC1=CC(=NN1C2=CC=C(C=C2)C#N)C
| PubChem CID | 15005387 |
|---|---|
| CAS | 56935-79-6 |
| Molecular Weight (g/mol) | 197.241 |
| MDL Number | MFCD09817559 |
| SMILES | CC1=CC(=NN1C2=CC=C(C=C2)C#N)C |
| Synonym | 4-3,5-dimethyl-1h-pyrazol-1-yl benzonitrile,4-3,5-dimethylpyrazol-1-yl benzonitrile,acmc-209luz,4-3,5-dimethylpyrazol-1-yl-benzonitrile,4-3,5-dimethylpyrazolyl benzenecarbonitrile,1-4-cyanophenyl-3,5-dimethyl-1h-pyrazole,benzonitrile, 4-3,5-dimethyl-1h-pyrazol-1-yl |
| IUPAC Name | 4-(3,5-dimethylpyrazol-1-yl)benzonitrile |
| InChI Key | BTXLPDNFEZIQBZ-UHFFFAOYSA-N |
| Molecular Formula | C12H11N3 |
5-(Chloromethyl)-3-(2-thienyl)-1,2,4-oxadiazole, ≥95%, Thermo Scientific™
CAS: 63417-81-2 Molecular Formula: C7H5ClN2OS Molecular Weight (g/mol): 200.64 MDL Number: MFCD03407322 InChI Key: YOUDLOUFERNGRO-UHFFFAOYSA-N Synonym: 5-chloromethyl-3-2-thienyl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4-oxadiazole,1,2,4-oxadiazole,5-chloromethyl-3-2-thienyl,5-chloromethyl-3-thien-2-yl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadiazole,2-5-chloromethyl-1,2,4-oxadiazol-3-yl thiophene,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadia zole PubChem CID: 736830 IUPAC Name: 5-(chloromethyl)-3-thiophen-2-yl-1,2,4-oxadiazole SMILES: ClCC1=NC(=NO1)C1=CC=CS1
| PubChem CID | 736830 |
|---|---|
| CAS | 63417-81-2 |
| Molecular Weight (g/mol) | 200.64 |
| MDL Number | MFCD03407322 |
| SMILES | ClCC1=NC(=NO1)C1=CC=CS1 |
| Synonym | 5-chloromethyl-3-2-thienyl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4-oxadiazole,1,2,4-oxadiazole,5-chloromethyl-3-2-thienyl,5-chloromethyl-3-thien-2-yl-1,2,4-oxadiazole,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadiazole,2-5-chloromethyl-1,2,4-oxadiazol-3-yl thiophene,5-chloromethyl-3-thiophen-2-yl-1,2,4 oxadia zole |
| IUPAC Name | 5-(chloromethyl)-3-thiophen-2-yl-1,2,4-oxadiazole |
| InChI Key | YOUDLOUFERNGRO-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClN2OS |
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'-Diethyl-2,2'-cyanine iodide, 99%
CAS: 977-96-8 Molecular Formula: C23H23IN2 Molecular Weight (g/mol): 454.34 MDL Number: MFCD00011971 InChI Key: GMYRVMSXMHEDTL-UHFFFAOYSA-M Synonym: decynium 22 PubChem CID: 71299759 ChEBI: CHEBI:37993 IUPAC Name: (2Z)-1-ethyl-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]quinoline;iodide SMILES: CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[I-]
| PubChem CID | 71299759 |
|---|---|
| CAS | 977-96-8 |
| Molecular Weight (g/mol) | 454.34 |
| ChEBI | CHEBI:37993 |
| MDL Number | MFCD00011971 |
| SMILES | CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41.[I-] |
| Synonym | decynium 22 |
| IUPAC Name | (2Z)-1-ethyl-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]quinoline;iodide |
| InChI Key | GMYRVMSXMHEDTL-UHFFFAOYSA-M |
| Molecular Formula | C23H23IN2 |
Quinoxaline, 98+%, Thermo Scientific Chemicals
CAS: 91-19-0 Molecular Formula: C8H6N2 Molecular Weight (g/mol): 130.15 MDL Number: MFCD00006719 InChI Key: XSCHRSMBECNVNS-UHFFFAOYSA-N Synonym: benzoparadiazine,1,4-benzodiazine,phenopiazine,phenpiazine,quinazine,benzopyrazine,1,4-diazanaphthalene,benzo a pyrazine,1,4-naphthyridine,chinoxalin PubChem CID: 7045 ChEBI: CHEBI:36616 IUPAC Name: quinoxaline SMILES: C1=CC=C2C(=C1)N=CC=N2
| PubChem CID | 7045 |
|---|---|
| CAS | 91-19-0 |
| Molecular Weight (g/mol) | 130.15 |
| ChEBI | CHEBI:36616 |
| MDL Number | MFCD00006719 |
| SMILES | C1=CC=C2C(=C1)N=CC=N2 |
| Synonym | benzoparadiazine,1,4-benzodiazine,phenopiazine,phenpiazine,quinazine,benzopyrazine,1,4-diazanaphthalene,benzo a pyrazine,1,4-naphthyridine,chinoxalin |
| IUPAC Name | quinoxaline |
| InChI Key | XSCHRSMBECNVNS-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2 |