Organoheterocyclic compounds
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Thermo Scientific Chemicals Diacetone-D-glucose, 98+%
CAS: 582-52-5 Molecular Formula: C12H20O6 Molecular Weight (g/mol): 260.28 MDL Number: MFCD00005544 InChI Key: KEJGAYKWRDILTF-MQIGXGKASA-N Synonym: 1,2:5,6-diisopropylidene-d-glucose,1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose,3ar,5r,6s,6as-5-4s-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol PubChem CID: 40469256 IUPAC Name: (3aR,5S,6S,6aS)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol SMILES: CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C
| PubChem CID | 40469256 |
|---|---|
| CAS | 582-52-5 |
| Molecular Weight (g/mol) | 260.28 |
| MDL Number | MFCD00005544 |
| SMILES | CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C |
| Synonym | 1,2:5,6-diisopropylidene-d-glucose,1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose,3ar,5r,6s,6as-5-4s-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol |
| IUPAC Name | (3aR,5S,6S,6aS)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol |
| InChI Key | KEJGAYKWRDILTF-MQIGXGKASA-N |
| Molecular Formula | C12H20O6 |
Tetrachlorobis(tetrahydrofuran)titanium(IV), 98%, Thermo Scientific Chemicals
CAS: 31011-57-1 Molecular Formula: C8H16Cl4O2Ti Molecular Weight (g/mol): 333.881 MDL Number: MFCD00077884 InChI Key: LXWBMENBONGPSB-UHFFFAOYSA-J Synonym: tetrachlorobis tetrahydrofuran titanium,tetrachlorobis tetrahydrofuran titanium iv,bis tetrahydrofuran ; titanium tetrachloride,titanium iv chloride tetrahydrofuran complex PubChem CID: 10958563 IUPAC Name: oxolane;tetrachlorotitanium SMILES: C1CCOC1.C1CCOC1.Cl[Ti](Cl)(Cl)Cl
| PubChem CID | 10958563 |
|---|---|
| CAS | 31011-57-1 |
| Molecular Weight (g/mol) | 333.881 |
| MDL Number | MFCD00077884 |
| SMILES | C1CCOC1.C1CCOC1.Cl[Ti](Cl)(Cl)Cl |
| Synonym | tetrachlorobis tetrahydrofuran titanium,tetrachlorobis tetrahydrofuran titanium iv,bis tetrahydrofuran ; titanium tetrachloride,titanium iv chloride tetrahydrofuran complex |
| IUPAC Name | oxolane;tetrachlorotitanium |
| InChI Key | LXWBMENBONGPSB-UHFFFAOYSA-J |
| Molecular Formula | C8H16Cl4O2Ti |
Thermo Scientific Chemicals 1,3,5-Tri-O-benzoyl-2-deoxy-2-fluoro-alpha-D-arabinofuranose
CAS: 97614-43-2 Molecular Formula: C26H21FO7 Molecular Weight (g/mol): 464.445 MDL Number: MFCD00083339 InChI Key: JOAHVPNLVYCSAN-UXGLMHHASA-N Synonym: 2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-arabinofuranose,2r,3s,4r,5r-5-benzoyloxy methyl-3-fluorotetrahydrofuran-2,4-diyl dibenzoate,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-,a-d-arabinofuranose,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-a-d-arabinofuranose,2r,3r,4s,5r-3,5-bis benzoyloxy-4-fluorooxolan-2-yl methyl benzoate,2r,3s,4r,5r-5-benzoyloxymethyl-3-fluoro-tetrahydrofuran-2,4-diyl dibenzoate,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-md-arabinose,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-d-ribofuranose,pubchem20401,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-ribofuranose PubChem CID: 11754171 IUPAC Name: [(2R,3R,4S,5R)-3,5-dibenzoyloxy-4-fluorooxolan-2-yl]methyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)OC(=O)C3=CC=CC=C3)F)OC(=O)C4=CC=CC=C4
| PubChem CID | 11754171 |
|---|---|
| CAS | 97614-43-2 |
| Molecular Weight (g/mol) | 464.445 |
| MDL Number | MFCD00083339 |
| SMILES | C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)OC(=O)C3=CC=CC=C3)F)OC(=O)C4=CC=CC=C4 |
| Synonym | 2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-arabinofuranose,2r,3s,4r,5r-5-benzoyloxy methyl-3-fluorotetrahydrofuran-2,4-diyl dibenzoate,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-,a-d-arabinofuranose,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-a-d-arabinofuranose,2r,3r,4s,5r-3,5-bis benzoyloxy-4-fluorooxolan-2-yl methyl benzoate,2r,3s,4r,5r-5-benzoyloxymethyl-3-fluoro-tetrahydrofuran-2,4-diyl dibenzoate,1,3,5-tri-o-benzoyl-2-deoxy-2-fluoro-md-arabinose,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-d-ribofuranose,pubchem20401,2-deoxy-2-fluoro-1,3,5-tri-o-benzoyl-alpha-d-ribofuranose |
| IUPAC Name | [(2R,3R,4S,5R)-3,5-dibenzoyloxy-4-fluorooxolan-2-yl]methyl benzoate |
| InChI Key | JOAHVPNLVYCSAN-UXGLMHHASA-N |
| Molecular Formula | C26H21FO7 |
(S)-(+)-3-Aminotetrahydrofuran hydrochloride, 95%
CAS: 204512-95-8 Molecular Formula: C4H10ClNO Molecular Weight (g/mol): 123.58 MDL Number: MFCD08445642 InChI Key: MHOVLDXJDIEEMJ-WCCKRBBISA-N Synonym: s-tetrahydrofuran-3-amine hydrochloride,s-3-aminotetrahydrofuran hydrochloride,3s-oxolan-3-amine hydrochloride,s-3-aminotetrahydrofuran hcl,s-tetrahydrofuran-3-amine hcl,s-tetrahydro-furan-3-ylamine hydrochloride,3-furanamine, tetrahydro-, hydrochloride, 3s,s-3-aminotetrahydrofuranhydrochloride,pubchem15126,ksc916a5t PubChem CID: 18664284 IUPAC Name: (3S)-oxolan-3-amine;hydrochloride SMILES: C1COCC1N.Cl
| PubChem CID | 18664284 |
|---|---|
| CAS | 204512-95-8 |
| Molecular Weight (g/mol) | 123.58 |
| MDL Number | MFCD08445642 |
| SMILES | C1COCC1N.Cl |
| Synonym | s-tetrahydrofuran-3-amine hydrochloride,s-3-aminotetrahydrofuran hydrochloride,3s-oxolan-3-amine hydrochloride,s-3-aminotetrahydrofuran hcl,s-tetrahydrofuran-3-amine hcl,s-tetrahydro-furan-3-ylamine hydrochloride,3-furanamine, tetrahydro-, hydrochloride, 3s,s-3-aminotetrahydrofuranhydrochloride,pubchem15126,ksc916a5t |
| IUPAC Name | (3S)-oxolan-3-amine;hydrochloride |
| InChI Key | MHOVLDXJDIEEMJ-WCCKRBBISA-N |
| Molecular Formula | C4H10ClNO |
Diacetone-D-glucose, 98+%
CAS: 582-52-5 Molecular Formula: C12H20O6 Molecular Weight (g/mol): 260.286 MDL Number: MFCD00005544 InChI Key: KEJGAYKWRDILTF-MQIGXGKASA-N Synonym: 1,2:5,6-diisopropylidene-d-glucose,1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose,3ar,5r,6s,6as-5-4s-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol PubChem CID: 40469256 IUPAC Name: (3aR,5S,6S,6aS)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol SMILES: CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C
| PubChem CID | 40469256 |
|---|---|
| CAS | 582-52-5 |
| Molecular Weight (g/mol) | 260.286 |
| MDL Number | MFCD00005544 |
| SMILES | CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)O)C |
| Synonym | 1,2:5,6-diisopropylidene-d-glucose,1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose,3ar,5r,6s,6as-5-4s-2,2-dimethyl-1,3-dioxolan-4-yl-2,2-dimethyl-tetrahydrofuro 2,3-d 1,3 dioxol-6-ol |
| IUPAC Name | (3aR,5S,6S,6aS)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol |
| InChI Key | KEJGAYKWRDILTF-MQIGXGKASA-N |
| Molecular Formula | C12H20O6 |
3-(2-Furyl)propanoic acid, 98%
CAS: 935-13-7 Molecular Formula: C7H8O3 Molecular Weight (g/mol): 140.14 InChI Key: XLTJXJJMUFDQEZ-UHFFFAOYSA-N Synonym: 3-furan-2-yl propanoic acid,3-2-furyl propanoic acid,2-furanpropanoic acid,2-furanpropionic acid,3-2-furyl propionic acid,3-furan-2-yl-propionic acid,furan-2-propionic acid,3-2-furyl propoinic acid,furfuryl-essigsaure,furfurylacetic acid PubChem CID: 70286 IUPAC Name: 3-(furan-2-yl)propanoic acid SMILES: C1=COC(=C1)CCC(=O)O
| PubChem CID | 70286 |
|---|---|
| CAS | 935-13-7 |
| Molecular Weight (g/mol) | 140.14 |
| SMILES | C1=COC(=C1)CCC(=O)O |
| Synonym | 3-furan-2-yl propanoic acid,3-2-furyl propanoic acid,2-furanpropanoic acid,2-furanpropionic acid,3-2-furyl propionic acid,3-furan-2-yl-propionic acid,furan-2-propionic acid,3-2-furyl propoinic acid,furfuryl-essigsaure,furfurylacetic acid |
| IUPAC Name | 3-(furan-2-yl)propanoic acid |
| InChI Key | XLTJXJJMUFDQEZ-UHFFFAOYSA-N |
| Molecular Formula | C7H8O3 |
3-(1H-Tetrazol-1-yl)aniline, 97%
CAS: 14213-12-8 Molecular Formula: C7H7N5 Molecular Weight (g/mol): 161.168 MDL Number: MFCD06687920 InChI Key: YXWXLBHIUVBLIH-UHFFFAOYSA-N Synonym: 3-1h-tetrazol-1-yl aniline,3-tetrazol-1-yl-phenylamine,3-1h-tetrazol-1-yl benzenamine,3-1,2,3,4-tetrazol-1-yl aniline,3-1h-1,2,3,4-tetrazol-1-yl aniline,3-tetrazol-1-yl phenylamine,3-1,2,3,4-tetraazolyl phenylamine,acmc-209cnn,3-tetrazol-1-yl aniline,3-tetrazol-1-ylphenylamine PubChem CID: 863007 IUPAC Name: 3-(tetrazol-1-yl)aniline SMILES: C1=CC(=CC(=C1)N)N2C=NN=N2
| PubChem CID | 863007 |
|---|---|
| CAS | 14213-12-8 |
| Molecular Weight (g/mol) | 161.168 |
| MDL Number | MFCD06687920 |
| SMILES | C1=CC(=CC(=C1)N)N2C=NN=N2 |
| Synonym | 3-1h-tetrazol-1-yl aniline,3-tetrazol-1-yl-phenylamine,3-1h-tetrazol-1-yl benzenamine,3-1,2,3,4-tetrazol-1-yl aniline,3-1h-1,2,3,4-tetrazol-1-yl aniline,3-tetrazol-1-yl phenylamine,3-1,2,3,4-tetraazolyl phenylamine,acmc-209cnn,3-tetrazol-1-yl aniline,3-tetrazol-1-ylphenylamine |
| IUPAC Name | 3-(tetrazol-1-yl)aniline |
| InChI Key | YXWXLBHIUVBLIH-UHFFFAOYSA-N |
| Molecular Formula | C7H7N5 |
Sulfur trioxide pyridine complex, technical, 48-50% active SO3
CAS: 26412-87-3 Molecular Formula: C5H5NO3S Molecular Weight (g/mol): 159.16 MDL Number: MFCD00012437 InChI Key: UDYFLDICVHJSOY-UHFFFAOYSA-N Synonym: pyridine sulfur trioxide,sulfur trioxide pyridine complex,pyridine; sulfur trioxide,pyridine sulfotrioxide,pyridine compound with sulfur trioxide 1:1,sulfur trioxide, compd. with pyridine,pyridine-sulfur trioxide complex,active sulfure trioxide,sulfur trioxide-pyridine,pyridine-sulfur trioxide PubChem CID: 168533 SMILES: O=S(=O)=O.C1=CC=NC=C1
| PubChem CID | 168533 |
|---|---|
| CAS | 26412-87-3 |
| Molecular Weight (g/mol) | 159.16 |
| MDL Number | MFCD00012437 |
| SMILES | O=S(=O)=O.C1=CC=NC=C1 |
| Synonym | pyridine sulfur trioxide,sulfur trioxide pyridine complex,pyridine; sulfur trioxide,pyridine sulfotrioxide,pyridine compound with sulfur trioxide 1:1,sulfur trioxide, compd. with pyridine,pyridine-sulfur trioxide complex,active sulfure trioxide,sulfur trioxide-pyridine,pyridine-sulfur trioxide |
| InChI Key | UDYFLDICVHJSOY-UHFFFAOYSA-N |
| Molecular Formula | C5H5NO3S |
Quinoxaline, 98+%
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 |
2-Methylimidazo[4,5-c]pyridine, 96%
CAS: 63604-59-1 Molecular Formula: C7H7N3 Molecular Weight (g/mol): 133.154 MDL Number: MFCD03426025 InChI Key: JWQVOMJORQXNME-UHFFFAOYSA-N Synonym: 2-methyl-3h-imidazo 4,5-c pyridine,2-methyl-1h-imidazo 4,5-c pyridine,2-methylimidazo 4,5-c pyridine,8-methyl-3-deazapurine,8-methyl-3,7,9-triazabicyclo 4.3.0 nona-2,4,7,10-tetraene,acmc-20anq0,2-methyl-5-azabenzimidazole,3h-imidazo 4,5-c pyridine, 2-methyl,1h-imidazo 4,5-c pyridine, 2-methyl PubChem CID: 373077 IUPAC Name: 2-methyl-3H-imidazo[4,5-c]pyridine SMILES: CC1=NC2=C(N1)C=NC=C2
| PubChem CID | 373077 |
|---|---|
| CAS | 63604-59-1 |
| Molecular Weight (g/mol) | 133.154 |
| MDL Number | MFCD03426025 |
| SMILES | CC1=NC2=C(N1)C=NC=C2 |
| Synonym | 2-methyl-3h-imidazo 4,5-c pyridine,2-methyl-1h-imidazo 4,5-c pyridine,2-methylimidazo 4,5-c pyridine,8-methyl-3-deazapurine,8-methyl-3,7,9-triazabicyclo 4.3.0 nona-2,4,7,10-tetraene,acmc-20anq0,2-methyl-5-azabenzimidazole,3h-imidazo 4,5-c pyridine, 2-methyl,1h-imidazo 4,5-c pyridine, 2-methyl |
| IUPAC Name | 2-methyl-3H-imidazo[4,5-c]pyridine |
| InChI Key | JWQVOMJORQXNME-UHFFFAOYSA-N |
| Molecular Formula | C7H7N3 |
2-Methylbenzimidazole, 98%
CAS: 615-15-6 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.17 MDL Number: MFCD00005598 InChI Key: LDZYRENCLPUXAX-UHFFFAOYSA-N Synonym: 2-methylbenzimidazole,2-methyl-1h-benzo d imidazole,1h-benzimidazole, 2-methyl,benzimidazole, 2-methyl,2-methyl-1h-benzoimidazole,2-methyl-1h-1,3-benzodiazole,acetamidine, n-n'-o-phenylene,2-methyl benzimidazole,unii-zh8iww7y8b,2-methylbenaimidazole PubChem CID: 11984 IUPAC Name: 2-methyl-1H-benzimidazole SMILES: CC1=NC2=CC=CC=C2N1
| PubChem CID | 11984 |
|---|---|
| CAS | 615-15-6 |
| Molecular Weight (g/mol) | 132.17 |
| MDL Number | MFCD00005598 |
| SMILES | CC1=NC2=CC=CC=C2N1 |
| Synonym | 2-methylbenzimidazole,2-methyl-1h-benzo d imidazole,1h-benzimidazole, 2-methyl,benzimidazole, 2-methyl,2-methyl-1h-benzoimidazole,2-methyl-1h-1,3-benzodiazole,acetamidine, n-n'-o-phenylene,2-methyl benzimidazole,unii-zh8iww7y8b,2-methylbenaimidazole |
| IUPAC Name | 2-methyl-1H-benzimidazole |
| InChI Key | LDZYRENCLPUXAX-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |
2-Thiopheneethanol, 98%
CAS: 5402-55-1 Molecular Formula: C6H8OS Molecular Weight (g/mol): 128.19 MDL Number: MFCD00005462 InChI Key: VMJOFTHFJMLIKL-UHFFFAOYSA-N Synonym: 2-thiopheneethanol,2-2-thienyl ethanol,thiophene-2-ethanol,2-thiophen-2-yl ethanol,2-2-hydroxyethyl thiophene,2-thiophen-2-yl ethan-1-ol,ethanol, 2-2-thienyl,2-thiophenethanol,2-2-thienyl-ethanol,2-thienylethanol PubChem CID: 79400 IUPAC Name: 2-thiophen-2-ylethanol SMILES: OCCC1=CC=CS1
| PubChem CID | 79400 |
|---|---|
| CAS | 5402-55-1 |
| Molecular Weight (g/mol) | 128.19 |
| MDL Number | MFCD00005462 |
| SMILES | OCCC1=CC=CS1 |
| Synonym | 2-thiopheneethanol,2-2-thienyl ethanol,thiophene-2-ethanol,2-thiophen-2-yl ethanol,2-2-hydroxyethyl thiophene,2-thiophen-2-yl ethan-1-ol,ethanol, 2-2-thienyl,2-thiophenethanol,2-2-thienyl-ethanol,2-thienylethanol |
| IUPAC Name | 2-thiophen-2-ylethanol |
| InChI Key | VMJOFTHFJMLIKL-UHFFFAOYSA-N |
| Molecular Formula | C6H8OS |
Pyrrole-2-carbonitrile, 99%
CAS: 4513-94-4 Molecular Formula: C5H4N2 Molecular Weight (g/mol): 92.10 MDL Number: MFCD00234061 InChI Key: BQMPGKPTOHKYHS-UHFFFAOYSA-N Synonym: pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile PubChem CID: 138277 IUPAC Name: 1H-pyrrole-2-carbonitrile SMILES: N#CC1=CC=CN1
| PubChem CID | 138277 |
|---|---|
| CAS | 4513-94-4 |
| Molecular Weight (g/mol) | 92.10 |
| MDL Number | MFCD00234061 |
| SMILES | N#CC1=CC=CN1 |
| Synonym | pyrrole-2-carbonitrile,2-cyanopyrrole,unii-6d25bmc1pp,2-carbonitrilepyrrole,6d25bmc1pp,cyanopyrrole,2-cyano-pyrrol,pyrrole carbonitrile,1h-pyrrolecarbonitrile,1h-pyrrol-2-kohlenitrile |
| IUPAC Name | 1H-pyrrole-2-carbonitrile |
| InChI Key | BQMPGKPTOHKYHS-UHFFFAOYSA-N |
| Molecular Formula | C5H4N2 |
Imidazole Slightly off-white, crystalline powder MP Biomedicals
CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N Synonym: imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole PubChem CID: 795 ChEBI: CHEBI:16069 IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1
| PubChem CID | 795 |
|---|---|
| CAS | 288-32-4 |
| Molecular Weight (g/mol) | 68.08 |
| ChEBI | CHEBI:16069 |
| MDL Number | MFCD00005183 |
| SMILES | N1C=CN=C1 |
| Synonym | imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole |
| IUPAC Name | 1H-imidazole |
| InChI Key | RAXXELZNTBOGNW-UHFFFAOYSA-N |
| Molecular Formula | C3H4N2 |
4-Methylthiazole, 99%
CAS: 693-95-8 Molecular Formula: C4H5NS Molecular Weight (g/mol): 99.15 MDL Number: MFCD00005340 InChI Key: QMHIMXFNBOYPND-UHFFFAOYSA-N Synonym: 4-methylthiazole,thiazole, 4-methyl,4-methyl thiazole,4-methyl-thiazole,fema no. 3716,4-methyl-5h-1,3-thiazole,4-methyithiazole,methylthiazole, 4,pubchem23683 PubChem CID: 12748 ChEBI: CHEBI:35626 IUPAC Name: 4-methyl-1,3-thiazole SMILES: CC1=CSC=N1
| PubChem CID | 12748 |
|---|---|
| CAS | 693-95-8 |
| Molecular Weight (g/mol) | 99.15 |
| ChEBI | CHEBI:35626 |
| MDL Number | MFCD00005340 |
| SMILES | CC1=CSC=N1 |
| Synonym | 4-methylthiazole,thiazole, 4-methyl,4-methyl thiazole,4-methyl-thiazole,fema no. 3716,4-methyl-5h-1,3-thiazole,4-methyithiazole,methylthiazole, 4,pubchem23683 |
| IUPAC Name | 4-methyl-1,3-thiazole |
| InChI Key | QMHIMXFNBOYPND-UHFFFAOYSA-N |
| Molecular Formula | C4H5NS |