Organooxygen compounds
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Ascorbic Acid, USP, bioCERTIFIED™, 1 kg, Spectrum Chemical
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D-myo-Inositol, 99.2%, Cell culture reagent, For HPLC analysis, MP Biomedicals™
CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00077932 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N Synonym: scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: C1(C(C(C(C(C1O)O)O)O)O)O
| PubChem CID | 892 |
|---|---|
| CAS | 87-89-8 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:24848 |
| MDL Number | MFCD00077932 |
| SMILES | C1(C(C(C(C(C1O)O)O)O)O)O |
| Synonym | scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |
(6-Thien-2-ylpyrid-3-yl)methanol, 95%, Thermo Scientific™
CAS: 198078-57-8 Molecular Formula: C10H9NOS Molecular Weight (g/mol): 191.248 MDL Number: MFCD06410427 InChI Key: OLHQRPWNQRBQMA-UHFFFAOYSA-N Synonym: 6-thien-2-ylpyrid-3-yl methanol,6-thiophen-2-yl pyridin-3-yl methanol,3-pyridinemethanol,6-2-thienyl,2-thien-2-yl-5-hydroxymethylpyridine,6-2-thienyl-3-pyridyl methan-1-ol PubChem CID: 15411145 IUPAC Name: (6-thiophen-2-ylpyridin-3-yl)methanol SMILES: C1=CSC(=C1)C2=NC=C(C=C2)CO
| PubChem CID | 15411145 |
|---|---|
| CAS | 198078-57-8 |
| Molecular Weight (g/mol) | 191.248 |
| MDL Number | MFCD06410427 |
| SMILES | C1=CSC(=C1)C2=NC=C(C=C2)CO |
| Synonym | 6-thien-2-ylpyrid-3-yl methanol,6-thiophen-2-yl pyridin-3-yl methanol,3-pyridinemethanol,6-2-thienyl,2-thien-2-yl-5-hydroxymethylpyridine,6-2-thienyl-3-pyridyl methan-1-ol |
| IUPAC Name | (6-thiophen-2-ylpyridin-3-yl)methanol |
| InChI Key | OLHQRPWNQRBQMA-UHFFFAOYSA-N |
| Molecular Formula | C10H9NOS |
7-Bromo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine, 97%, Thermo Scientific™
CAS: 34950-82-8 Molecular Formula: C7H7BrN2O Molecular Weight (g/mol): 215.05 MDL Number: MFCD09025906 InChI Key: CYISPVTTZWJFEO-UHFFFAOYSA-N Synonym: 7-bromo-3,4-dihydro-2h-pyrido 3,2-b 1,4 oxazine,7-bromo-3,4-dihydro-2h-pyrido 3,2-b-1,4-oxazine,7-bromo-2h,3h,4h-pyrido 3,2-b 1,4 oxazine,7-bromo-2h,3h,4h-pyridino 2,3-e 1,4-oxazine,pubchem18740,acmc-1aimz,abbypharma ap-13-10238,2h-pyrido 3,2-b-1,4-oxazine,7-bromo-3,4-dihydro PubChem CID: 24229635 SMILES: BrC1=CN=C2NCCOC2=C1
| PubChem CID | 24229635 |
|---|---|
| CAS | 34950-82-8 |
| Molecular Weight (g/mol) | 215.05 |
| MDL Number | MFCD09025906 |
| SMILES | BrC1=CN=C2NCCOC2=C1 |
| Synonym | 7-bromo-3,4-dihydro-2h-pyrido 3,2-b 1,4 oxazine,7-bromo-3,4-dihydro-2h-pyrido 3,2-b-1,4-oxazine,7-bromo-2h,3h,4h-pyrido 3,2-b 1,4 oxazine,7-bromo-2h,3h,4h-pyridino 2,3-e 1,4-oxazine,pubchem18740,acmc-1aimz,abbypharma ap-13-10238,2h-pyrido 3,2-b-1,4-oxazine,7-bromo-3,4-dihydro |
| InChI Key | CYISPVTTZWJFEO-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrN2O |
Ethyl thiophene-2-glyoxylate, 97%
CAS: 4075-58-5 Molecular Formula: C8H8O3S Molecular Weight (g/mol): 184.209 MDL Number: MFCD00015538 InChI Key: GHOVLEQTRNXASK-UHFFFAOYSA-N Synonym: ethyl thiophene-2-glyoxylate,ethyl 2-oxo-2-thiophen-2-yl acetate,ethyl 2-oxo-2-2-thienyl acetate,ethyl alpha-oxothiophen-2-acetate,ethyl 2-thienylglyoxylate,thiophen-2-coco-o-ethyl,2-thiophene glyoxylic acid ethyl ester,oxo-thiophen-2-yl-acetic acid ethyl ester,2-thiophene glyoxalicacid ethyl ester,ethyl oxo 2-thienyl acetate PubChem CID: 77693 IUPAC Name: ethyl 2-oxo-2-thiophen-2-ylacetate SMILES: CCOC(=O)C(=O)C1=CC=CS1
| PubChem CID | 77693 |
|---|---|
| CAS | 4075-58-5 |
| Molecular Weight (g/mol) | 184.209 |
| MDL Number | MFCD00015538 |
| SMILES | CCOC(=O)C(=O)C1=CC=CS1 |
| Synonym | ethyl thiophene-2-glyoxylate,ethyl 2-oxo-2-thiophen-2-yl acetate,ethyl 2-oxo-2-2-thienyl acetate,ethyl alpha-oxothiophen-2-acetate,ethyl 2-thienylglyoxylate,thiophen-2-coco-o-ethyl,2-thiophene glyoxylic acid ethyl ester,oxo-thiophen-2-yl-acetic acid ethyl ester,2-thiophene glyoxalicacid ethyl ester,ethyl oxo 2-thienyl acetate |
| IUPAC Name | ethyl 2-oxo-2-thiophen-2-ylacetate |
| InChI Key | GHOVLEQTRNXASK-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3S |
2-Ethoxybenzaldehyde, 97+%
CAS: 613-69-4 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00003316 InChI Key: DUVJMSPTZMCSTQ-UHFFFAOYSA-N Synonym: benzaldehyde, 2-ethoxy,o-ethoxybenzaldehyde,2-ethoxy benzaldehyde,benzaldehyde, o-ethoxy,2-ethoxy-benzaldehyde,benzaldehyde, ethoxy,ethoxy benzaldehyde,pubchem9726,ortho-ethoxybenzaldehyde,acmc-209ms1 PubChem CID: 11950 IUPAC Name: 2-ethoxybenzaldehyde SMILES: CCOC1=CC=CC=C1C=O
| PubChem CID | 11950 |
|---|---|
| CAS | 613-69-4 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00003316 |
| SMILES | CCOC1=CC=CC=C1C=O |
| Synonym | benzaldehyde, 2-ethoxy,o-ethoxybenzaldehyde,2-ethoxy benzaldehyde,benzaldehyde, o-ethoxy,2-ethoxy-benzaldehyde,benzaldehyde, ethoxy,ethoxy benzaldehyde,pubchem9726,ortho-ethoxybenzaldehyde,acmc-209ms1 |
| IUPAC Name | 2-ethoxybenzaldehyde |
| InChI Key | DUVJMSPTZMCSTQ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
Spectrum Chemical Manufacturing Corporation Pyrogallol, Crystal, Reagent, ACS, Spectrum™ Chemical
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CAS: 87-66-1 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00002192 InChI Key: WQGWDDDVZFFDIG-UHFFFAOYSA-N IUPAC Name: benzene-1,2,3-triol SMILES: OC1=CC=CC(O)=C1O
| CAS | 87-66-1 |
|---|---|
| Molecular Weight (g/mol) | 126.11 |
| MDL Number | MFCD00002192 |
| SMILES | OC1=CC=CC(O)=C1O |
| IUPAC Name | benzene-1,2,3-triol |
| InChI Key | WQGWDDDVZFFDIG-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
5-Chloro-2-furaldehyde, 98%, stab. with 2% ethanol
CAS: 21508-19-0 Molecular Formula: C5H3ClO2 Molecular Weight (g/mol): 130.527 MDL Number: MFCD02752599 InChI Key: DGAUAVDWXYXXGQ-UHFFFAOYSA-N Synonym: 5-chloro-2-furaldehyde,5-chlorofurfural,2-furancarboxaldehyde, 5-chloro,5-chloro-furfural,2-chlorofuran-5-aldehyde,acmc-1cq7z,5-chloro-furan-2carbaldehyde,5-chlorofuran-2 carbaldehyde,5-chloro-furan-2-carbaldehyde,5-chlorofuran-2-carboxaldehyde PubChem CID: 2769630 IUPAC Name: 5-chlorofuran-2-carbaldehyde SMILES: C1=C(OC(=C1)Cl)C=O
| PubChem CID | 2769630 |
|---|---|
| CAS | 21508-19-0 |
| Molecular Weight (g/mol) | 130.527 |
| MDL Number | MFCD02752599 |
| SMILES | C1=C(OC(=C1)Cl)C=O |
| Synonym | 5-chloro-2-furaldehyde,5-chlorofurfural,2-furancarboxaldehyde, 5-chloro,5-chloro-furfural,2-chlorofuran-5-aldehyde,acmc-1cq7z,5-chloro-furan-2carbaldehyde,5-chlorofuran-2 carbaldehyde,5-chloro-furan-2-carbaldehyde,5-chlorofuran-2-carboxaldehyde |
| IUPAC Name | 5-chlorofuran-2-carbaldehyde |
| InChI Key | DGAUAVDWXYXXGQ-UHFFFAOYSA-N |
| Molecular Formula | C5H3ClO2 |
Isobutyl Alcohol, BAKER ANALYZED™ A.C.S. Reagent, J.T. Baker™
Synonym: 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol
| Synonym | 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol |
|---|
Tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionato)zirconium(IV), 99.9%, Thermo Scientific™
CAS: 18865-74-2 Molecular Formula: C44H80O8Zr Molecular Weight (g/mol): 828.34 MDL Number: MFCD00145380,MFCD00145380 InChI Key: ANBXKEDJQLYCLX-UHFFFAOYSA-N Synonym: tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionato zirconium,zirconium 2,2,6,6-tetramethyl-3,5-heptanedionate,tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionato zirconium iv,zr tmhd 4,zirconium tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionate,zirconium tetrakis dipivaloylmethanate,zirconium iv 2,2,6,6-tetramethyl-3,5-heptanedionate,4z-2,2,6,6-tetramethyl-5-tris 3z-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy zirconio oxy hept-4-en-3-one PubChem CID: 50919870 IUPAC Name: 5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;zirconium SMILES: [Zr].CC(C)(C)C(O)=CC(=O)C(C)(C)C.CC(C)(C)C(O)=CC(=O)C(C)(C)C.CC(C)(C)C(O)=CC(=O)C(C)(C)C.CC(C)(C)C(O)=CC(=O)C(C)(C)C
| PubChem CID | 50919870 |
|---|---|
| CAS | 18865-74-2 |
| Molecular Weight (g/mol) | 828.34 |
| MDL Number | MFCD00145380,MFCD00145380 |
| SMILES | [Zr].CC(C)(C)C(O)=CC(=O)C(C)(C)C.CC(C)(C)C(O)=CC(=O)C(C)(C)C.CC(C)(C)C(O)=CC(=O)C(C)(C)C.CC(C)(C)C(O)=CC(=O)C(C)(C)C |
| Synonym | tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionato zirconium,zirconium 2,2,6,6-tetramethyl-3,5-heptanedionate,tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionato zirconium iv,zr tmhd 4,zirconium tetrakis 2,2,6,6-tetramethyl-3,5-heptanedionate,zirconium tetrakis dipivaloylmethanate,zirconium iv 2,2,6,6-tetramethyl-3,5-heptanedionate,4z-2,2,6,6-tetramethyl-5-tris 3z-2,2,6,6-tetramethyl-5-oxohept-3-en-3-yl oxy zirconio oxy hept-4-en-3-one |
| IUPAC Name | 5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;zirconium |
| InChI Key | ANBXKEDJQLYCLX-UHFFFAOYSA-N |
| Molecular Formula | C44H80O8Zr |
2-(Trifluoromethoxy)benzaldehyde, 96%
CAS: 94651-33-9 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.12 MDL Number: MFCD00042405 InChI Key: CPHXLFKIUVVIOQ-UHFFFAOYSA-N Synonym: 2-trifluoromethoxy benzaldehyde,4-trifluoromethoxy,o-trifluoromethoxy benzaldehyde,2-trifluoromethoxy-benzaldehyde,pubchem1469,trifluoromethoxybenzaldehyde,acmc-209rt0,o-trifluoromethoxybenzaldehyde,trifluoromethoxy benzaldehyde PubChem CID: 2777192 IUPAC Name: 2-(trifluoromethoxy)benzaldehyde SMILES: FC(F)(F)OC1=CC=CC=C1C=O
| PubChem CID | 2777192 |
|---|---|
| CAS | 94651-33-9 |
| Molecular Weight (g/mol) | 190.12 |
| MDL Number | MFCD00042405 |
| SMILES | FC(F)(F)OC1=CC=CC=C1C=O |
| Synonym | 2-trifluoromethoxy benzaldehyde,4-trifluoromethoxy,o-trifluoromethoxy benzaldehyde,2-trifluoromethoxy-benzaldehyde,pubchem1469,trifluoromethoxybenzaldehyde,acmc-209rt0,o-trifluoromethoxybenzaldehyde,trifluoromethoxy benzaldehyde |
| IUPAC Name | 2-(trifluoromethoxy)benzaldehyde |
| InChI Key | CPHXLFKIUVVIOQ-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O2 |
4-(5-Methyl-1,2,4-oxadiazol-3-yl)benzaldehyde, 97%, Thermo Scientific™
CAS: 852180-60-0 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.186 MDL Number: MFCD07772818 InChI Key: BJICSBRPQDVEHP-UHFFFAOYSA-N Synonym: 4-5-methyl-1,2,4-oxadiazol-3-yl benzaldehyde,benzaldehyde,4-5-methyl-1,2,4-oxadiazol-3-yl PubChem CID: 7164589 IUPAC Name: 4-(5-methyl-1,2,4-oxadiazol-3-yl)benzaldehyde SMILES: CC1=NC(=NO1)C2=CC=C(C=C2)C=O
| PubChem CID | 7164589 |
|---|---|
| CAS | 852180-60-0 |
| Molecular Weight (g/mol) | 188.186 |
| MDL Number | MFCD07772818 |
| SMILES | CC1=NC(=NO1)C2=CC=C(C=C2)C=O |
| Synonym | 4-5-methyl-1,2,4-oxadiazol-3-yl benzaldehyde,benzaldehyde,4-5-methyl-1,2,4-oxadiazol-3-yl |
| IUPAC Name | 4-(5-methyl-1,2,4-oxadiazol-3-yl)benzaldehyde |
| InChI Key | BJICSBRPQDVEHP-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2O2 |
Diethyl tert-butylmalonate, 96%
CAS: 759-24-0 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.28 MDL Number: MFCD00009152 InChI Key: RJNICNBRGVKNSR-UHFFFAOYSA-N Synonym: diethyl tert-butylmalonate,diethyl t-butylmalonate,diethyl 1,1-dimethylethyl malonate,diethyl 2-tert-butyl malonate,propanedioic acid, 1,1-dimethylethyl-, diethyl ester,diethyltert-butylmalonate,diethyl 2-tert-butylmalonate #,tert-butylmalonic acid diethyl ester,1,3-diethyl 2-tert-butylpropanedioate PubChem CID: 69798 IUPAC Name: diethyl 2-tert-butylpropanedioate SMILES: CCOC(=O)C(C(=O)OCC)C(C)(C)C
| PubChem CID | 69798 |
|---|---|
| CAS | 759-24-0 |
| Molecular Weight (g/mol) | 216.28 |
| MDL Number | MFCD00009152 |
| SMILES | CCOC(=O)C(C(=O)OCC)C(C)(C)C |
| Synonym | diethyl tert-butylmalonate,diethyl t-butylmalonate,diethyl 1,1-dimethylethyl malonate,diethyl 2-tert-butyl malonate,propanedioic acid, 1,1-dimethylethyl-, diethyl ester,diethyltert-butylmalonate,diethyl 2-tert-butylmalonate #,tert-butylmalonic acid diethyl ester,1,3-diethyl 2-tert-butylpropanedioate |
| IUPAC Name | diethyl 2-tert-butylpropanedioate |
| InChI Key | RJNICNBRGVKNSR-UHFFFAOYSA-N |
| Molecular Formula | C11H20O4 |
1-Naphthalenemethanol, 98+%
CAS: 4780-79-4 Molecular Formula: C11H10O Molecular Weight (g/mol): 158.20 MDL Number: MFCD00004044 InChI Key: PBLNHHSDYFYZNC-UHFFFAOYSA-N Synonym: 1-naphthalenemethanol,1-naphthylmethanol,1-hydroxymethylnaphthalene,naphthalene-1-methanol,1-naphthalene methanol,1-menaphthyl alcohol,1-naphthylmethyl alcohol,naphthalen-1-yl-methanol,naphthalen-1-yl methanol,1-naphthylenemethanol PubChem CID: 20908 ChEBI: CHEBI:38137 IUPAC Name: naphthalen-1-ylmethanol SMILES: OCC1=C2C=CC=CC2=CC=C1
| PubChem CID | 20908 |
|---|---|
| CAS | 4780-79-4 |
| Molecular Weight (g/mol) | 158.20 |
| ChEBI | CHEBI:38137 |
| MDL Number | MFCD00004044 |
| SMILES | OCC1=C2C=CC=CC2=CC=C1 |
| Synonym | 1-naphthalenemethanol,1-naphthylmethanol,1-hydroxymethylnaphthalene,naphthalene-1-methanol,1-naphthalene methanol,1-menaphthyl alcohol,1-naphthylmethyl alcohol,naphthalen-1-yl-methanol,naphthalen-1-yl methanol,1-naphthylenemethanol |
| IUPAC Name | naphthalen-1-ylmethanol |
| InChI Key | PBLNHHSDYFYZNC-UHFFFAOYSA-N |
| Molecular Formula | C11H10O |
Cafestol from Coffee Beans, MP Biomedicals™
CAS: 469-83-0 Molecular Formula: C20H28O3 Molecular Weight (g/mol): 316.44 MDL Number: MFCD01075769 InChI Key: DNJVYWXIDISQRD-HWUKTEKMSA-N IUPAC Name: (1S,4S,12S,13R,16R,17R)-17-(hydroxymethyl)-12-methyl-8-oxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁵,⁹]nonadeca-5(9),6-dien-17-ol SMILES: C[C@@]12CCC3=C(C=CO3)[C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)[C@@](O)(CO)C3
| CAS | 469-83-0 |
|---|---|
| Molecular Weight (g/mol) | 316.44 |
| MDL Number | MFCD01075769 |
| SMILES | C[C@@]12CCC3=C(C=CO3)[C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)[C@@](O)(CO)C3 |
| IUPAC Name | (1S,4S,12S,13R,16R,17R)-17-(hydroxymethyl)-12-methyl-8-oxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁵,⁹]nonadeca-5(9),6-dien-17-ol |
| InChI Key | DNJVYWXIDISQRD-HWUKTEKMSA-N |
| Molecular Formula | C20H28O3 |