Organooxygen compounds
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4-Nitrobenzo-15-crown-5, 99%, Thermo Scientific Chemicals
CAS: 60835-69-0 Molecular Formula: C14H19NO7 Molecular Weight (g/mol): 313.306 MDL Number: MFCD00060713 InChI Key: XIWRBQVYCZCEPG-UHFFFAOYSA-N Synonym: 4-nitrobenzo-15-crown-5,4'-nitrobenzo-15-crown-5,nitrobenzo-15-crown-5,15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine,17-nitro-2,5,8,11,14-pentaoxabicyclo 13.4.0 nonadeca-1 15 ,16,18-triene,17-nitro-2,3-benzo-1,4,7,10,13-pentaoxacyclopentadecen-2,4-nitro-benzo-15-crown-5,xiwrbqvyczcepg-uhfffaoysa,4'-nitrobenzo-15-crown 5-ether PubChem CID: 143747 IUPAC Name: 17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene SMILES: C1COCCOC2=C(C=C(C=C2)[N+](=O)[O-])OCCOCCO1
| PubChem CID | 143747 |
|---|---|
| CAS | 60835-69-0 |
| Molecular Weight (g/mol) | 313.306 |
| MDL Number | MFCD00060713 |
| SMILES | C1COCCOC2=C(C=C(C=C2)[N+](=O)[O-])OCCOCCO1 |
| Synonym | 4-nitrobenzo-15-crown-5,4'-nitrobenzo-15-crown-5,nitrobenzo-15-crown-5,15-nitro-2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecine,17-nitro-2,5,8,11,14-pentaoxabicyclo 13.4.0 nonadeca-1 15 ,16,18-triene,17-nitro-2,3-benzo-1,4,7,10,13-pentaoxacyclopentadecen-2,4-nitro-benzo-15-crown-5,xiwrbqvyczcepg-uhfffaoysa,4'-nitrobenzo-15-crown 5-ether |
| IUPAC Name | 17-nitro-2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-triene |
| InChI Key | XIWRBQVYCZCEPG-UHFFFAOYSA-N |
| Molecular Formula | C14H19NO7 |
Diethylene glycol monobutyl ether, For surfactant analysis, ≥99.0%, MilliporeSigma™ Supelco™
MDL Number: MFCD00002881 Synonym: 2-(2-Butoxyethoxy)ethanol; BDG; Butyldiglycol
| MDL Number | MFCD00002881 |
|---|---|
| Synonym | 2-(2-Butoxyethoxy)ethanol; BDG; Butyldiglycol |
2,2'-(Ethylenedioxy)bis(ethylamine), 97+%
CAS: 929-59-9 Molecular Formula: C6H16N2O2 Molecular Weight (g/mol): 148.206 MDL Number: MFCD00040474 InChI Key: IWBOPFCKHIJFMS-UHFFFAOYSA-N Synonym: 1,8-diamino-3,6-dioxaoctane,1,2-bis 2-aminoethoxy ethane,2,2'-ethylenedioxy bis ethylamine,unii-r41zt4uf34,2,2'-ethane-1,2-diylbis oxy diethanamine,3,6-dioxaoctamethylenediamine,2-2-2-aminoethoxy ethoxy ethanamine,3,6-dioxaoctane-1,8-diamine,ethylene glycol bis 2-aminoethyl ether PubChem CID: 70248 IUPAC Name: 2-[2-(2-aminoethoxy)ethoxy]ethanamine SMILES: C(COCCOCCN)N
| PubChem CID | 70248 |
|---|---|
| CAS | 929-59-9 |
| Molecular Weight (g/mol) | 148.206 |
| MDL Number | MFCD00040474 |
| SMILES | C(COCCOCCN)N |
| Synonym | 1,8-diamino-3,6-dioxaoctane,1,2-bis 2-aminoethoxy ethane,2,2'-ethylenedioxy bis ethylamine,unii-r41zt4uf34,2,2'-ethane-1,2-diylbis oxy diethanamine,3,6-dioxaoctamethylenediamine,2-2-2-aminoethoxy ethoxy ethanamine,3,6-dioxaoctane-1,8-diamine,ethylene glycol bis 2-aminoethyl ether |
| IUPAC Name | 2-[2-(2-aminoethoxy)ethoxy]ethanamine |
| InChI Key | IWBOPFCKHIJFMS-UHFFFAOYSA-N |
| Molecular Formula | C6H16N2O2 |
Bromoacetaldehyde diethyl acetal, 97%
CAS: 2032-35-1 Molecular Formula: C6H13BrO2 Molecular Weight (g/mol): 197.07 MDL Number: MFCD00000214 InChI Key: LILXDMFJXYAKMK-UHFFFAOYSA-N Synonym: bromoacetaldehyde diethyl acetal,bromoacetal,2,2-diethoxyethyl bromide,ethane, 2-bromo-1,1-diethoxy,bromacetal,1-bromo-2,2-diethoxyethane,diethyl bromoacetal,2-bromoacetaldehyde diethyl acetal,1,1-diethoxy-2-bromoethane,diethyl bromoacetaldehyde acetal PubChem CID: 74852 IUPAC Name: 2-bromo-1,1-diethoxyethane SMILES: CCOC(CBr)OCC
| PubChem CID | 74852 |
|---|---|
| CAS | 2032-35-1 |
| Molecular Weight (g/mol) | 197.07 |
| MDL Number | MFCD00000214 |
| SMILES | CCOC(CBr)OCC |
| Synonym | bromoacetaldehyde diethyl acetal,bromoacetal,2,2-diethoxyethyl bromide,ethane, 2-bromo-1,1-diethoxy,bromacetal,1-bromo-2,2-diethoxyethane,diethyl bromoacetal,2-bromoacetaldehyde diethyl acetal,1,1-diethoxy-2-bromoethane,diethyl bromoacetaldehyde acetal |
| IUPAC Name | 2-bromo-1,1-diethoxyethane |
| InChI Key | LILXDMFJXYAKMK-UHFFFAOYSA-N |
| Molecular Formula | C6H13BrO2 |
Ascorbic Acid, Fine Granular, 20 to 80 Mesh, U.S.P. - F.C.C., J.T. Baker™
CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N Synonym: l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin PubChem CID: 54670067 ChEBI: CHEBI:29073 IUPAC Name: (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| PubChem CID | 54670067 |
|---|---|
| CAS | 50-81-7 |
| Molecular Weight (g/mol) | 176.12 |
| ChEBI | CHEBI:29073 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| Synonym | l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin |
| IUPAC Name | (2R)-2-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2H-furan-5-one |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
4-Chloro-1-butanol, 85%, balance THF and HCl
CAS: 928-51-8 Molecular Formula: C4H9ClO Molecular Weight (g/mol): 108.57 MDL Number: MFCD00002967 InChI Key: HXHGULXINZUGJX-UHFFFAOYSA-N Synonym: 4-chloro-1-butanol,4-chlorobutanol,1-butanol, 4-chloro,tetramethylene chlorohydrin,4-chloro-1-butane-ol,4-chlorbutan-1-ol,unii-42ei3i5ay0,4-chlorbutan-1-ol german,ccris 7507,4-chloro-butan-1-ol PubChem CID: 13569 ChEBI: CHEBI:87310 IUPAC Name: 4-chlorobutan-1-ol SMILES: OCCCCCl
| PubChem CID | 13569 |
|---|---|
| CAS | 928-51-8 |
| Molecular Weight (g/mol) | 108.57 |
| ChEBI | CHEBI:87310 |
| MDL Number | MFCD00002967 |
| SMILES | OCCCCCl |
| Synonym | 4-chloro-1-butanol,4-chlorobutanol,1-butanol, 4-chloro,tetramethylene chlorohydrin,4-chloro-1-butane-ol,4-chlorbutan-1-ol,unii-42ei3i5ay0,4-chlorbutan-1-ol german,ccris 7507,4-chloro-butan-1-ol |
| IUPAC Name | 4-chlorobutan-1-ol |
| InChI Key | HXHGULXINZUGJX-UHFFFAOYSA-N |
| Molecular Formula | C4H9ClO |
3-Ethyl-3-hexanol, 98%, Thermo Scientific Chemicals
CAS: 597-76-2 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.23 MDL Number: MFCD00039616 InChI Key: WNDLTOTUHMHNOC-UHFFFAOYSA-N Synonym: 3-ethyl-3-hexanol,3-hexanol, 3-ethyl,1,1-diethyl-1-butanol,diethyl n-propyl carbinol,acmc-1ak6h PubChem CID: 69008 IUPAC Name: 3-ethylhexan-3-ol SMILES: CCCC(O)(CC)CC
| PubChem CID | 69008 |
|---|---|
| CAS | 597-76-2 |
| Molecular Weight (g/mol) | 130.23 |
| MDL Number | MFCD00039616 |
| SMILES | CCCC(O)(CC)CC |
| Synonym | 3-ethyl-3-hexanol,3-hexanol, 3-ethyl,1,1-diethyl-1-butanol,diethyl n-propyl carbinol,acmc-1ak6h |
| IUPAC Name | 3-ethylhexan-3-ol |
| InChI Key | WNDLTOTUHMHNOC-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
1,2-Pentanediol, 96%
CAS: 5343-92-0 Molecular Formula: C5H12O2 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00010736 InChI Key: WCVRQHFDJLLWFE-UHFFFAOYNA-N Synonym: 1,2-pentanediol,1,2-dihydroxypentane,1,2-pentanediol, 2r,acmc-20mbh5,acmc-1axdb,3-01-00-02191 beilstein handbook reference,ksc271i3n,wcvrqhfdjllwfe-uhfffaoysa PubChem CID: 93000 IUPAC Name: pentane-1,2-diol SMILES: CCCC(O)CO
| PubChem CID | 93000 |
|---|---|
| CAS | 5343-92-0 |
| Molecular Weight (g/mol) | 104.15 |
| MDL Number | MFCD00010736 |
| SMILES | CCCC(O)CO |
| Synonym | 1,2-pentanediol,1,2-dihydroxypentane,1,2-pentanediol, 2r,acmc-20mbh5,acmc-1axdb,3-01-00-02191 beilstein handbook reference,ksc271i3n,wcvrqhfdjllwfe-uhfffaoysa |
| IUPAC Name | pentane-1,2-diol |
| InChI Key | WCVRQHFDJLLWFE-UHFFFAOYNA-N |
| Molecular Formula | C5H12O2 |
trans-1,4-Cyclohexanedimethanol, 98%
CAS: 3236-48-4 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00001512,MFCD00066360 InChI Key: YIMQCDZDWXUDCA-UHFFFAOYSA-N Synonym: 1,4-cyclohexanedimethanol,trans-1,4-cyclohexanedimethanol,chdm,1,4-bis hydroxymethyl cyclohexane,rikabinol dm,cyclohexane-1,4-dimethanol,1,4-chidm,1,4-dimethylolcyclohexane,4-hydroxymethyl cyclohexyl methanol,1,4-cyclohexanedimethanol, cis PubChem CID: 7735 IUPAC Name: [4-(hydroxymethyl)cyclohexyl]methanol SMILES: OCC1CCC(CO)CC1
| PubChem CID | 7735 |
|---|---|
| CAS | 3236-48-4 |
| Molecular Weight (g/mol) | 144.21 |
| MDL Number | MFCD00001512,MFCD00066360 |
| SMILES | OCC1CCC(CO)CC1 |
| Synonym | 1,4-cyclohexanedimethanol,trans-1,4-cyclohexanedimethanol,chdm,1,4-bis hydroxymethyl cyclohexane,rikabinol dm,cyclohexane-1,4-dimethanol,1,4-chidm,1,4-dimethylolcyclohexane,4-hydroxymethyl cyclohexyl methanol,1,4-cyclohexanedimethanol, cis |
| IUPAC Name | [4-(hydroxymethyl)cyclohexyl]methanol |
| InChI Key | YIMQCDZDWXUDCA-UHFFFAOYSA-N |
| Molecular Formula | C8H16O2 |
Oleyl alcohol, 99+%
CAS: 143-28-2 Molecular Formula: C18H36O Molecular Weight (g/mol): 268.49 MDL Number: MFCD00002993 InChI Key: ALSTYHKOOCGGFT-KTKRTIGZSA-N Synonym: oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol PubChem CID: 5284499 ChEBI: CHEBI:73504 IUPAC Name: (Z)-octadec-9-en-1-ol SMILES: CCCCCCCC\C=C/CCCCCCCCO
| PubChem CID | 5284499 |
|---|---|
| CAS | 143-28-2 |
| Molecular Weight (g/mol) | 268.49 |
| ChEBI | CHEBI:73504 |
| MDL Number | MFCD00002993 |
| SMILES | CCCCCCCC\C=C/CCCCCCCCO |
| Synonym | oleyl alcohol,cis-9-octadecen-1-ol,z-octadec-9-en-1-ol,ocenol,conditioner 1,dermaffine,lancol,novol,oceol,oleol |
| IUPAC Name | (Z)-octadec-9-en-1-ol |
| InChI Key | ALSTYHKOOCGGFT-KTKRTIGZSA-N |
| Molecular Formula | C18H36O |
4-Bromo-1-butanol, tech., cont. varying amounts of THF
CAS: 33036-62-3 Molecular Formula: C4H9BrO Molecular Weight (g/mol): 153.019 MDL Number: MFCD00015387 InChI Key: SIJLYRDVTMMSIP-UHFFFAOYSA-N Synonym: 4-bromo-1-butanol,1-butanol, 4-bromo,4-bromobutanol,4-bromo-butan-1-ol,1-bromo-4-hydroxybutane,tetramethylene bromohydrin,4-bromo-n-butanol,1-bromobutan-4-ol,4-bromo butan-1-ol,acmc-1axcv PubChem CID: 118388 IUPAC Name: 4-bromobutan-1-ol SMILES: C(CCBr)CO
| PubChem CID | 118388 |
|---|---|
| CAS | 33036-62-3 |
| Molecular Weight (g/mol) | 153.019 |
| MDL Number | MFCD00015387 |
| SMILES | C(CCBr)CO |
| Synonym | 4-bromo-1-butanol,1-butanol, 4-bromo,4-bromobutanol,4-bromo-butan-1-ol,1-bromo-4-hydroxybutane,tetramethylene bromohydrin,4-bromo-n-butanol,1-bromobutan-4-ol,4-bromo butan-1-ol,acmc-1axcv |
| IUPAC Name | 4-bromobutan-1-ol |
| InChI Key | SIJLYRDVTMMSIP-UHFFFAOYSA-N |
| Molecular Formula | C4H9BrO |
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 |
2-Methyl-1-propanol, 99+%, Extra Pure
CAS: 78-83-1 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.12 MDL Number: MFCD00004740 InChI Key: ZXEKIIBDNHEJCQ-UHFFFAOYSA-N 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 PubChem CID: 6560 ChEBI: CHEBI:46645 IUPAC Name: 2-methylpropan-1-ol SMILES: CC(C)CO
| PubChem CID | 6560 |
|---|---|
| CAS | 78-83-1 |
| Molecular Weight (g/mol) | 74.12 |
| ChEBI | CHEBI:46645 |
| MDL Number | MFCD00004740 |
| SMILES | CC(C)CO |
| 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 |
| IUPAC Name | 2-methylpropan-1-ol |
| InChI Key | ZXEKIIBDNHEJCQ-UHFFFAOYSA-N |
| Molecular Formula | C4H10O |
Ethyl 4-hydroxycyclohexanecarboxylate, cis + trans, 97%
CAS: 17159-80-7 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.22 MDL Number: MFCD00192156,MFCD16295187 InChI Key: BZKQJSLASWRDNE-UHFFFAOYSA-N Synonym: ethyl 4-hydroxycyclohexanecarboxylate,trans-ethyl 4-hydroxycyclohexanecarboxylate,ethyl trans-4-hydroxycyclohexanecarboxylate,4-hydroxy-cyclohexanecarboxylic acid ethyl ester,ethyl 4-hydroxycyclohexane carboxylate,cis-ethyl 4-hydroxycyclohexanecarboxylate,cyclohexanecarboxylic acid, 4-hydroxy-, ethyl ester,4-hydroxycyclohexanecarboxylic acid ethyl ester,trans-4-hydroxycyclohexanecarboxylic acid ethyl ester,cyclohexanecarboxylic acid, 4-hydroxy-, ethyl ester, cis PubChem CID: 86973 IUPAC Name: ethyl 4-hydroxycyclohexane-1-carboxylate SMILES: CCOC(=O)C1CCC(O)CC1
| PubChem CID | 86973 |
|---|---|
| CAS | 17159-80-7 |
| Molecular Weight (g/mol) | 172.22 |
| MDL Number | MFCD00192156,MFCD16295187 |
| SMILES | CCOC(=O)C1CCC(O)CC1 |
| Synonym | ethyl 4-hydroxycyclohexanecarboxylate,trans-ethyl 4-hydroxycyclohexanecarboxylate,ethyl trans-4-hydroxycyclohexanecarboxylate,4-hydroxy-cyclohexanecarboxylic acid ethyl ester,ethyl 4-hydroxycyclohexane carboxylate,cis-ethyl 4-hydroxycyclohexanecarboxylate,cyclohexanecarboxylic acid, 4-hydroxy-, ethyl ester,4-hydroxycyclohexanecarboxylic acid ethyl ester,trans-4-hydroxycyclohexanecarboxylic acid ethyl ester,cyclohexanecarboxylic acid, 4-hydroxy-, ethyl ester, cis |
| IUPAC Name | ethyl 4-hydroxycyclohexane-1-carboxylate |
| InChI Key | BZKQJSLASWRDNE-UHFFFAOYSA-N |
| Molecular Formula | C9H16O3 |