Organooxygen compounds
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cis-2-Penten-1-ol, 97%, remainder mainly trans-isomer
CAS: 1576-95-0 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00063208 InChI Key: BTSIZIIPFNVMHF-ARJAWSKDSA-N Synonym: cis-2-penten-1-ol,z-pent-2-en-1-ol,z-2-penten-1-ol,2-penten-1-ol, z,e-2-penten-1-ol,unii-qnc2nb53mj,2z-penten-1-ol,cis-2-pentenol,qnc2nb53mj,pent-2 e-enol PubChem CID: 5364919 SMILES: CC\C=C/CO
| PubChem CID | 5364919 |
|---|---|
| CAS | 1576-95-0 |
| Molecular Weight (g/mol) | 86.13 |
| MDL Number | MFCD00063208 |
| SMILES | CC\C=C/CO |
| Synonym | cis-2-penten-1-ol,z-pent-2-en-1-ol,z-2-penten-1-ol,2-penten-1-ol, z,e-2-penten-1-ol,unii-qnc2nb53mj,2z-penten-1-ol,cis-2-pentenol,qnc2nb53mj,pent-2 e-enol |
| InChI Key | BTSIZIIPFNVMHF-ARJAWSKDSA-N |
| Molecular Formula | C5H10O |
Neopentyl alcohol, 99%
CAS: 75-84-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00004682 InChI Key: KPSSIOMAKSHJJG-UHFFFAOYSA-N Synonym: neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol PubChem CID: 6404 IUPAC Name: 2,2-dimethylpropan-1-ol SMILES: CC(C)(C)CO
| PubChem CID | 6404 |
|---|---|
| CAS | 75-84-3 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00004682 |
| SMILES | CC(C)(C)CO |
| Synonym | neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol |
| IUPAC Name | 2,2-dimethylpropan-1-ol |
| InChI Key | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
Benzyl chloromethyl ether, 75%
CAS: 3587-60-8 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00000886 InChI Key: LADPCMZCENPFGV-UHFFFAOYSA-N Synonym: benzyl chloromethyl ether,chloromethoxymethyl benzene,chloromethoxy methyl benzene,benzyloxymethyl chloride,chloromethoxymethyl-benzene,benzyl chloromethylether,benzene, chloromethoxy methyl PubChem CID: 137983 IUPAC Name: chloromethoxymethylbenzene SMILES: C1=CC=C(C=C1)COCCl
| PubChem CID | 137983 |
|---|---|
| CAS | 3587-60-8 |
| Molecular Weight (g/mol) | 156.61 |
| MDL Number | MFCD00000886 |
| SMILES | C1=CC=C(C=C1)COCCl |
| Synonym | benzyl chloromethyl ether,chloromethoxymethyl benzene,chloromethoxy methyl benzene,benzyloxymethyl chloride,chloromethoxymethyl-benzene,benzyl chloromethylether,benzene, chloromethoxy methyl |
| IUPAC Name | chloromethoxymethylbenzene |
| InChI Key | LADPCMZCENPFGV-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
4,4'-Dichlorobutyrophenone, 97%, Thermo Scientific™
CAS: 40877-09-6 Molecular Formula: C10H10Cl2O Molecular Weight (g/mol): 217.09 MDL Number: MFCD00018993 InChI Key: UKCHLVFIVJBCKE-UHFFFAOYSA-N Synonym: 4-chloro-1-4-chlorophenyl butan-1-one,4,4'-dichlorobutyrophenone,1-butanone, 4-chloro-1-4-chlorophenyl,gamma,p-dichlorobutyrophenone,4-chloro-1-4-chlorophenyl-1-oxobutane,4-chloro-1-4-chlorophenyl-1-butanone,acmc-20a5su,4',gamma-dichlorobutyrophenone,4-chloro-4'-chlorobutyrophenone,4-chloro-4'-chloro-butyrophenone PubChem CID: 2723781 IUPAC Name: 4-chloro-1-(4-chlorophenyl)butan-1-one SMILES: C1=CC(=CC=C1C(=O)CCCCl)Cl
| PubChem CID | 2723781 |
|---|---|
| CAS | 40877-09-6 |
| Molecular Weight (g/mol) | 217.09 |
| MDL Number | MFCD00018993 |
| SMILES | C1=CC(=CC=C1C(=O)CCCCl)Cl |
| Synonym | 4-chloro-1-4-chlorophenyl butan-1-one,4,4'-dichlorobutyrophenone,1-butanone, 4-chloro-1-4-chlorophenyl,gamma,p-dichlorobutyrophenone,4-chloro-1-4-chlorophenyl-1-oxobutane,4-chloro-1-4-chlorophenyl-1-butanone,acmc-20a5su,4',gamma-dichlorobutyrophenone,4-chloro-4'-chlorobutyrophenone,4-chloro-4'-chloro-butyrophenone |
| IUPAC Name | 4-chloro-1-(4-chlorophenyl)butan-1-one |
| InChI Key | UKCHLVFIVJBCKE-UHFFFAOYSA-N |
| Molecular Formula | C10H10Cl2O |
4,4'-Biphenyldicarboxaldehyde, 97%
CAS: 66-98-8 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00016714 InChI Key: FEHLIYXNTWAEBQ-UHFFFAOYSA-N Synonym: 4,4'-biphenyldicarboxaldehyde,1,1'-biphenyl-4,4'-dicarbaldehyde,4,4'-diformylbiphenyl,biphenyl-4,4'-dicarbaldehyde,4,4'-biphenyldicarboxyaldehyde,1,1'-biphenyl-4,4'-dicarboxaldehyde,p,p'-diformylbiphenyl,4-4-formylphenyl benzaldehyde,4,4'-bis formyl biphenyl PubChem CID: 6200 IUPAC Name: 4-(4-formylphenyl)benzaldehyde SMILES: C1=CC(=CC=C1C=O)C2=CC=C(C=C2)C=O
| PubChem CID | 6200 |
|---|---|
| CAS | 66-98-8 |
| Molecular Weight (g/mol) | 210.23 |
| MDL Number | MFCD00016714 |
| SMILES | C1=CC(=CC=C1C=O)C2=CC=C(C=C2)C=O |
| Synonym | 4,4'-biphenyldicarboxaldehyde,1,1'-biphenyl-4,4'-dicarbaldehyde,4,4'-diformylbiphenyl,biphenyl-4,4'-dicarbaldehyde,4,4'-biphenyldicarboxyaldehyde,1,1'-biphenyl-4,4'-dicarboxaldehyde,p,p'-diformylbiphenyl,4-4-formylphenyl benzaldehyde,4,4'-bis formyl biphenyl |
| IUPAC Name | 4-(4-formylphenyl)benzaldehyde |
| InChI Key | FEHLIYXNTWAEBQ-UHFFFAOYSA-N |
| Molecular Formula | C14H10O2 |
tert-Amyl Alcohol, 99%, Spectrum™ Chemical
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CAS: 75-85-4
| CAS | 75-85-4 |
|---|
3,4-Dimethoxy-3-cyclobutene-1,2-dione, 98%
CAS: 5222-73-1 Molecular Formula: C6H6O4 Molecular Weight (g/mol): 142.11 MDL Number: MFCD00101316 InChI Key: SZBNZTGCAMLMJY-UHFFFAOYSA-N PubChem CID: 123227 IUPAC Name: 3,4-dimethoxycyclobut-3-ene-1,2-dione SMILES: COC1=C(C(=O)C1=O)OC
| PubChem CID | 123227 |
|---|---|
| CAS | 5222-73-1 |
| Molecular Weight (g/mol) | 142.11 |
| MDL Number | MFCD00101316 |
| SMILES | COC1=C(C(=O)C1=O)OC |
| IUPAC Name | 3,4-dimethoxycyclobut-3-ene-1,2-dione |
| InChI Key | SZBNZTGCAMLMJY-UHFFFAOYSA-N |
| Molecular Formula | C6H6O4 |
Nickel acetylacetonate, 96%
CAS: 3264-82-2 Molecular Formula: C10H14NiO4 Molecular Weight (g/mol): 256.91 MDL Number: MFCD00000024 InChI Key: BMGNSKKZFQMGDH-FDGPNNRMSA-L Synonym: nickel ii acetylacetonate,bis 2,4-pentanedionato nickel ii hydrate,acetylacetone nickel ii salt,bis 2,4-pentanedionato nickel ii PubChem CID: 53384569 IUPAC Name: nickel(2+);(E)-4-oxopent-2-en-2-olate SMILES: [Ni++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
| PubChem CID | 53384569 |
|---|---|
| CAS | 3264-82-2 |
| Molecular Weight (g/mol) | 256.91 |
| MDL Number | MFCD00000024 |
| SMILES | [Ni++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O |
| Synonym | nickel ii acetylacetonate,bis 2,4-pentanedionato nickel ii hydrate,acetylacetone nickel ii salt,bis 2,4-pentanedionato nickel ii |
| IUPAC Name | nickel(2+);(E)-4-oxopent-2-en-2-olate |
| InChI Key | BMGNSKKZFQMGDH-FDGPNNRMSA-L |
| Molecular Formula | C10H14NiO4 |
5-Methoxyindole, 98%
CAS: 1006-94-6 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00005674 InChI Key: DWAQDRSOVMLGRQ-UHFFFAOYSA-N Synonym: 5-methoxyindole,1h-indole, 5-methoxy,femedol,5-methoxy indole,indol-5-yl methyl ether,indole, 5-methoxy,methoxy-5 indole,unii-dqm3as43pq,methoxy-5 indole french,methoxyindole 5- PubChem CID: 13872 IUPAC Name: 5-methoxy-1H-indole SMILES: COC1=CC2=C(C=C1)NC=C2
| PubChem CID | 13872 |
|---|---|
| CAS | 1006-94-6 |
| Molecular Weight (g/mol) | 147.18 |
| MDL Number | MFCD00005674 |
| SMILES | COC1=CC2=C(C=C1)NC=C2 |
| Synonym | 5-methoxyindole,1h-indole, 5-methoxy,femedol,5-methoxy indole,indol-5-yl methyl ether,indole, 5-methoxy,methoxy-5 indole,unii-dqm3as43pq,methoxy-5 indole french,methoxyindole 5- |
| IUPAC Name | 5-methoxy-1H-indole |
| InChI Key | DWAQDRSOVMLGRQ-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
2-Bromo-2',4'-dimethoxyacetophenone, 98%
CAS: 60965-26-6 Molecular Formula: C10H11BrO3 Molecular Weight (g/mol): 259.09 MDL Number: MFCD00000197 InChI Key: PKVBZABQCCQHLD-UHFFFAOYSA-N Synonym: 2-bromo-1-2,4-dimethoxyphenyl ethanone,2-bromo-2',4'-dimethoxyacetophenone,2,4-dimethoxyphenacyl bromide,2-bromo-1-2',4'-dimethoxyphenyl ethanone,2-bromo-1-2,4-dimethoxyphenyl ethan-1-one,ethanone, 2-bromo-1-2,4-dimethoxyphenyl,2-bromo-2',4'-dimethoxyacetopheneone,1-2,4-dimethoxyphenyl-2-bromoethan-1-one,pubchem13433,acmc-1ba4l PubChem CID: 98683 IUPAC Name: 2-bromo-1-(2,4-dimethoxyphenyl)ethanone SMILES: COC1=CC(=C(C=C1)C(=O)CBr)OC
| PubChem CID | 98683 |
|---|---|
| CAS | 60965-26-6 |
| Molecular Weight (g/mol) | 259.09 |
| MDL Number | MFCD00000197 |
| SMILES | COC1=CC(=C(C=C1)C(=O)CBr)OC |
| Synonym | 2-bromo-1-2,4-dimethoxyphenyl ethanone,2-bromo-2',4'-dimethoxyacetophenone,2,4-dimethoxyphenacyl bromide,2-bromo-1-2',4'-dimethoxyphenyl ethanone,2-bromo-1-2,4-dimethoxyphenyl ethan-1-one,ethanone, 2-bromo-1-2,4-dimethoxyphenyl,2-bromo-2',4'-dimethoxyacetopheneone,1-2,4-dimethoxyphenyl-2-bromoethan-1-one,pubchem13433,acmc-1ba4l |
| IUPAC Name | 2-bromo-1-(2,4-dimethoxyphenyl)ethanone |
| InChI Key | PKVBZABQCCQHLD-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO3 |
Tris(dibenzylideneacetone)dipalladium(0), Pd 21.5% min
CAS: 51364-51-3 Molecular Formula: C51H42O3Pd2 Molecular Weight (g/mol): 915.73 MDL Number: MFCD00013310 InChI Key: CYPYTURSJDMMMP-UHFFFAOYSA-N Synonym: tris dibenzylideneacetone dipalladium 0,tris dibenzylideneacetone dipalladium,pd2 dba 3,tris dibezylideneacetone dipalladium,tris dibenzylideneacetone dipalladium o,tris dibenzylideneacetonyl bis-palladium,tris dba,tris 1e,4e-1,5-diphenylpenta-1,4-dien-3-one dipalladium PubChem CID: 9811564 IUPAC Name: (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium SMILES: [Pd].[Pd].O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1
| PubChem CID | 9811564 |
|---|---|
| CAS | 51364-51-3 |
| Molecular Weight (g/mol) | 915.73 |
| MDL Number | MFCD00013310 |
| SMILES | [Pd].[Pd].O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1 |
| Synonym | tris dibenzylideneacetone dipalladium 0,tris dibenzylideneacetone dipalladium,pd2 dba 3,tris dibezylideneacetone dipalladium,tris dibenzylideneacetone dipalladium o,tris dibenzylideneacetonyl bis-palladium,tris dba,tris 1e,4e-1,5-diphenylpenta-1,4-dien-3-one dipalladium |
| IUPAC Name | (1E,4E)-1,5-diphenylpenta-1,4-dien-3-one;palladium |
| InChI Key | CYPYTURSJDMMMP-UHFFFAOYSA-N |
| Molecular Formula | C51H42O3Pd2 |
Isopropyl Ether, Stabilized, ACS, 99%, Spectrum™ Chemical
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CAS: 108-20-3
| CAS | 108-20-3 |
|---|
Methyl 2-oxoindane-1-carboxylate, 97%
CAS: 104620-34-0 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD06200715 InChI Key: RWSYHHRDYRDVQL-UHFFFAOYSA-N Synonym: methyl 2-oxo-1-indanecarboxylate,methyl 2-oxoindane-1-carboxylate,methyl2-oxo-1-indanecarboxylate,methyl 2-oxo-2,3-dihydro-1h-indene-1-carboxylate,1h-indene-1-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester,acmc-20agv9,1-methoxycarbonyl-2-indanone,2-oxo-indan-1-carboxylic acid methyl ester,2-oxo-1,3-dihydro-indene-1-carboxylic acid methyl ester PubChem CID: 10888732 IUPAC Name: methyl 2-oxo-1,3-dihydroindene-1-carboxylate SMILES: COC(=O)C1C(=O)CC2=CC=CC=C12
| PubChem CID | 10888732 |
|---|---|
| CAS | 104620-34-0 |
| Molecular Weight (g/mol) | 190.198 |
| MDL Number | MFCD06200715 |
| SMILES | COC(=O)C1C(=O)CC2=CC=CC=C12 |
| Synonym | methyl 2-oxo-1-indanecarboxylate,methyl 2-oxoindane-1-carboxylate,methyl2-oxo-1-indanecarboxylate,methyl 2-oxo-2,3-dihydro-1h-indene-1-carboxylate,1h-indene-1-carboxylic acid, 2,3-dihydro-2-oxo-, methyl ester,acmc-20agv9,1-methoxycarbonyl-2-indanone,2-oxo-indan-1-carboxylic acid methyl ester,2-oxo-1,3-dihydro-indene-1-carboxylic acid methyl ester |
| IUPAC Name | methyl 2-oxo-1,3-dihydroindene-1-carboxylate |
| InChI Key | RWSYHHRDYRDVQL-UHFFFAOYSA-N |
| Molecular Formula | C11H10O3 |
2,3-Dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde, ≥97%, Thermo Scientific™
CAS: 204905-77-1 Molecular Formula: C7H6O3S Molecular Weight (g/mol): 170.182 MDL Number: MFCD01651766 InChI Key: GNVXYRDVJKJZTO-UHFFFAOYSA-N Synonym: 2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,3,4-ethylenedioxythiophene-2-carbaldehyde,3,4-ethylenedioxythiophene-2-carboxaldehyde,2-formyl-3,4-ethylene dioxythiophene,2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde, 2,3-dihydro PubChem CID: 3540090 IUPAC Name: 2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde SMILES: C1COC2=C(SC=C2O1)C=O
| PubChem CID | 3540090 |
|---|---|
| CAS | 204905-77-1 |
| Molecular Weight (g/mol) | 170.182 |
| MDL Number | MFCD01651766 |
| SMILES | C1COC2=C(SC=C2O1)C=O |
| Synonym | 2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carbaldehyde,2h,3h-thieno 3,4-b 1,4 dioxine-5-carbaldehyde,3,4-ethylenedioxythiophene-2-carbaldehyde,3,4-ethylenedioxythiophene-2-carboxaldehyde,2-formyl-3,4-ethylene dioxythiophene,2h,3h-thiopheno 3,4-e 1,4-dioxane-5-carbaldehyde,2,3-dihydrothieno 3,4-b-1,4-dioxin-5-carbaldehyde,2,3-dihydrothieno 3,4-b 1,4 dioxine-5-carboxaldehyde,thieno 3,4-b-1,4-dioxin-5-carboxaldehyde, 2,3-dihydro |
| IUPAC Name | 2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carbaldehyde |
| InChI Key | GNVXYRDVJKJZTO-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3S |
10-Bromo-1-decanol, 95%
CAS: 53463-68-6 Molecular Formula: C10H21BrO Molecular Weight (g/mol): 237.18 MDL Number: MFCD00041681 InChI Key: LGZMUUBPTDRQQM-UHFFFAOYSA-N Synonym: 10-bromo-1-decanol,10-bromodecanol,1-decanol, 10-bromo,10-hydroxy-1-bromo decane,1-bromodecan-10-ol,10-bromodecane-1-ol,10-bromo-decan-1-ol,decamethylene bromohydrin,10-hydroxy1-bromo decane,acmc-209l7p PubChem CID: 104507 IUPAC Name: 10-bromodecan-1-ol SMILES: OCCCCCCCCCCBr
| PubChem CID | 104507 |
|---|---|
| CAS | 53463-68-6 |
| Molecular Weight (g/mol) | 237.18 |
| MDL Number | MFCD00041681 |
| SMILES | OCCCCCCCCCCBr |
| Synonym | 10-bromo-1-decanol,10-bromodecanol,1-decanol, 10-bromo,10-hydroxy-1-bromo decane,1-bromodecan-10-ol,10-bromodecane-1-ol,10-bromo-decan-1-ol,decamethylene bromohydrin,10-hydroxy1-bromo decane,acmc-209l7p |
| IUPAC Name | 10-bromodecan-1-ol |
| InChI Key | LGZMUUBPTDRQQM-UHFFFAOYSA-N |
| Molecular Formula | C10H21BrO |