Organooxygen compounds
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3'-Hydroxyacetophenone 98.0+%, TCI America™
CAS: 121-71-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002298 InChI Key: LUJMEECXHPYQOF-UHFFFAOYSA-N Synonym: 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol PubChem CID: 8487 IUPAC Name: 1-(3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)O
| PubChem CID | 8487 |
|---|---|
| CAS | 121-71-1 |
| Molecular Weight (g/mol) | 136.15 |
| MDL Number | MFCD00002298 |
| SMILES | CC(=O)C1=CC(=CC=C1)O |
| Synonym | 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol |
| IUPAC Name | 1-(3-hydroxyphenyl)ethanone |
| InChI Key | LUJMEECXHPYQOF-UHFFFAOYSA-N |
| Molecular Formula | C8H8O2 |
3-Mercapto-3-methyl-1-butanol 98.0+%, TCI America™
CAS: 34300-94-2 Molecular Formula: C5H12OS Molecular Weight (g/mol): 120.21 MDL Number: MFCD00101881 InChI Key: GBCGIJAYTBMFHI-UHFFFAOYSA-N PubChem CID: 520682 IUPAC Name: 3-methyl-3-sulfanylbutan-1-ol SMILES: CC(C)(S)CCO
| PubChem CID | 520682 |
|---|---|
| CAS | 34300-94-2 |
| Molecular Weight (g/mol) | 120.21 |
| MDL Number | MFCD00101881 |
| SMILES | CC(C)(S)CCO |
| IUPAC Name | 3-methyl-3-sulfanylbutan-1-ol |
| InChI Key | GBCGIJAYTBMFHI-UHFFFAOYSA-N |
| Molecular Formula | C5H12OS |
2-(4-Piperidyl)-2-propanol 98.0+%, TCI America™
CAS: 22990-34-7 Molecular Formula: C8H17NO Molecular Weight (g/mol): 143.23 MDL Number: MFCD06797159 InChI Key: IIXYTWTZMGUQPT-UHFFFAOYSA-N Synonym: 2-(4-Piperidyl)isopropyl Alcohol PubChem CID: 5200321 IUPAC Name: 2-(piperidin-4-yl)propan-2-ol SMILES: CC(C)(O)C1CCNCC1
| PubChem CID | 5200321 |
|---|---|
| CAS | 22990-34-7 |
| Molecular Weight (g/mol) | 143.23 |
| MDL Number | MFCD06797159 |
| SMILES | CC(C)(O)C1CCNCC1 |
| Synonym | 2-(4-Piperidyl)isopropyl Alcohol |
| IUPAC Name | 2-(piperidin-4-yl)propan-2-ol |
| InChI Key | IIXYTWTZMGUQPT-UHFFFAOYSA-N |
| Molecular Formula | C8H17NO |
10-Bromo-1-decanol 85.0+%, TCI America™
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 |
9-Bromo-1-nonanol 95.0+%, TCI America™
CAS: 55362-80-6 Molecular Formula: C9H19BrO Molecular Weight (g/mol): 223.15 MDL Number: MFCD00063348 InChI Key: USJDOLXCPFASNV-UHFFFAOYSA-N Synonym: 9-bromo-1-nonanol,1-nonanol, 9-bromo,9-bromo-nonan-1-ol,nonamethylene bromohydrin,9-bromnonan-1-ol,9-bromononanol,9-bromononyl alcohol,pubchem23429,9-bromo nonanol,acmc-1axfq PubChem CID: 108700 IUPAC Name: 9-bromononan-1-ol SMILES: OCCCCCCCCCBr
| PubChem CID | 108700 |
|---|---|
| CAS | 55362-80-6 |
| Molecular Weight (g/mol) | 223.15 |
| MDL Number | MFCD00063348 |
| SMILES | OCCCCCCCCCBr |
| Synonym | 9-bromo-1-nonanol,1-nonanol, 9-bromo,9-bromo-nonan-1-ol,nonamethylene bromohydrin,9-bromnonan-1-ol,9-bromononanol,9-bromononyl alcohol,pubchem23429,9-bromo nonanol,acmc-1axfq |
| IUPAC Name | 9-bromononan-1-ol |
| InChI Key | USJDOLXCPFASNV-UHFFFAOYSA-N |
| Molecular Formula | C9H19BrO |
Syringaldehyde 98.0+%, TCI America™
CAS: 134-96-3 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00006943 InChI Key: KCDXJAYRVLXPFO-UHFFFAOYSA-N Synonym: syringaldehyde,3,5-dimethoxy-4-hydroxybenzaldehyde,syringic aldehyde,syringylaldehyde,syringealdehyde,benzaldehyde, 4-hydroxy-3,5-dimethoxy,gallaldehyde 3,5-dimethyl ether,3,5-dimethoxy-4-hydroxybenzene carbonal,4-hydroxy-3,5-dimethoxy-benzaldehyde,springaldehyde PubChem CID: 8655 ChEBI: CHEBI:67380 IUPAC Name: 4-hydroxy-3,5-dimethoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(OC)=C1O
| PubChem CID | 8655 |
|---|---|
| CAS | 134-96-3 |
| Molecular Weight (g/mol) | 182.18 |
| ChEBI | CHEBI:67380 |
| MDL Number | MFCD00006943 |
| SMILES | COC1=CC(C=O)=CC(OC)=C1O |
| Synonym | syringaldehyde,3,5-dimethoxy-4-hydroxybenzaldehyde,syringic aldehyde,syringylaldehyde,syringealdehyde,benzaldehyde, 4-hydroxy-3,5-dimethoxy,gallaldehyde 3,5-dimethyl ether,3,5-dimethoxy-4-hydroxybenzene carbonal,4-hydroxy-3,5-dimethoxy-benzaldehyde,springaldehyde |
| IUPAC Name | 4-hydroxy-3,5-dimethoxybenzaldehyde |
| InChI Key | KCDXJAYRVLXPFO-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4 |
Isoamyl DL-Mandelate 93.0+%, TCI America™
CAS: 5421-04-5 Molecular Formula: C13H18O3 Molecular Weight (g/mol): 222.28 MDL Number: MFCD00021858 InChI Key: KQQXUARABJGCMS-UHFFFAOYNA-N Synonym: DL-Mandelic Acid Isoamyl Ester, Isopentyl DL-Mandelate, DL-Mandelic Acid Isopentyl Ester PubChem CID: 95396 IUPAC Name: 3-methylbutyl 2-hydroxy-2-phenylacetate SMILES: CC(C)CCOC(=O)C(C1=CC=CC=C1)O
| PubChem CID | 95396 |
|---|---|
| CAS | 5421-04-5 |
| Molecular Weight (g/mol) | 222.28 |
| MDL Number | MFCD00021858 |
| SMILES | CC(C)CCOC(=O)C(C1=CC=CC=C1)O |
| Synonym | DL-Mandelic Acid Isoamyl Ester, Isopentyl DL-Mandelate, DL-Mandelic Acid Isopentyl Ester |
| IUPAC Name | 3-methylbutyl 2-hydroxy-2-phenylacetate |
| InChI Key | KQQXUARABJGCMS-UHFFFAOYNA-N |
| Molecular Formula | C13H18O3 |
5-Bromo-1-indanone 98.0+%, TCI America™
CAS: 34598-49-7 Molecular Formula: C9H7BrO Molecular Weight (g/mol): 211.058 MDL Number: MFCD00082718 InChI Key: KSONICAHAPRCMV-UHFFFAOYSA-N Synonym: 5-bromo-1-indanone,5-bromoindanone,5-bromoindan-1-one,5-bromo-2,3-dihydro-1h-inden-1-one,1h-inden-1-one, 5-bromo-2,3-dihydro,1-indanone, 5-bromo,5-bromo-indanone,5-bromo indanone,zlchem 204,5-bromo-1-oxoindane PubChem CID: 520695 IUPAC Name: 5-bromo-2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=C1C=C(C=C2)Br
| PubChem CID | 520695 |
|---|---|
| CAS | 34598-49-7 |
| Molecular Weight (g/mol) | 211.058 |
| MDL Number | MFCD00082718 |
| SMILES | C1CC(=O)C2=C1C=C(C=C2)Br |
| Synonym | 5-bromo-1-indanone,5-bromoindanone,5-bromoindan-1-one,5-bromo-2,3-dihydro-1h-inden-1-one,1h-inden-1-one, 5-bromo-2,3-dihydro,1-indanone, 5-bromo,5-bromo-indanone,5-bromo indanone,zlchem 204,5-bromo-1-oxoindane |
| IUPAC Name | 5-bromo-2,3-dihydroinden-1-one |
| InChI Key | KSONICAHAPRCMV-UHFFFAOYSA-N |
| Molecular Formula | C9H7BrO |
Sodium (Trihydroxy)phenylborate 98.0+%, TCI America™
CAS: 52542-80-0 Molecular Formula: C6H8BNaO3 Molecular Weight (g/mol): 161.927 InChI Key: ZNXSFEXRXNJDNK-UHFFFAOYSA-N PubChem CID: 44629933 IUPAC Name: sodium;trihydroxy(phenyl)boranuide SMILES: [B-](C1=CC=CC=C1)(O)(O)O.[Na+]
| PubChem CID | 44629933 |
|---|---|
| CAS | 52542-80-0 |
| Molecular Weight (g/mol) | 161.927 |
| SMILES | [B-](C1=CC=CC=C1)(O)(O)O.[Na+] |
| IUPAC Name | sodium;trihydroxy(phenyl)boranuide |
| InChI Key | ZNXSFEXRXNJDNK-UHFFFAOYSA-N |
| Molecular Formula | C6H8BNaO3 |
Isochroman 98.0+%, TCI America™
CAS: 493-05-0 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00006913 InChI Key: HEBMCVBCEDMUOF-UHFFFAOYSA-N Synonym: isochroman,isochromane,3,4-dihydro-1h-2-benzopyran,1h-2-benzopyran, 3,4-dihydro,3,4-dihydro-1h-benzo c pyran,pubchem20553,acmc-209kfu,isochroman 10g,ksc237m1l PubChem CID: 96266 ChEBI: CHEBI:33225 IUPAC Name: 3,4-dihydro-1H-2-benzopyran SMILES: C1CC2=CC=CC=C2CO1
| PubChem CID | 96266 |
|---|---|
| CAS | 493-05-0 |
| Molecular Weight (g/mol) | 134.18 |
| ChEBI | CHEBI:33225 |
| MDL Number | MFCD00006913 |
| SMILES | C1CC2=CC=CC=C2CO1 |
| Synonym | isochroman,isochromane,3,4-dihydro-1h-2-benzopyran,1h-2-benzopyran, 3,4-dihydro,3,4-dihydro-1h-benzo c pyran,pubchem20553,acmc-209kfu,isochroman 10g,ksc237m1l |
| IUPAC Name | 3,4-dihydro-1H-2-benzopyran |
| InChI Key | HEBMCVBCEDMUOF-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2-Mercaptoethanol 99.0+%, TCI America™
CAS: 60-24-2 Molecular Formula: C2H6OS Molecular Weight (g/mol): 78.13 MDL Number: MFCD00004890 InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N Synonym: 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan PubChem CID: 1567 ChEBI: CHEBI:41218 IUPAC Name: 2-sulfanylethan-1-ol SMILES: OCCS
| PubChem CID | 1567 |
|---|---|
| CAS | 60-24-2 |
| Molecular Weight (g/mol) | 78.13 |
| ChEBI | CHEBI:41218 |
| MDL Number | MFCD00004890 |
| SMILES | OCCS |
| Synonym | 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan |
| IUPAC Name | 2-sulfanylethan-1-ol |
| InChI Key | DGVVWUTYPXICAM-UHFFFAOYSA-N |
| Molecular Formula | C2H6OS |
3-Bromosalicylaldehyde 98.0+%, TCI America™
CAS: 1829-34-1 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD00016587 InChI Key: STBGLXMINLWCNL-UHFFFAOYSA-N PubChem CID: 10910555 IUPAC Name: 3-bromo-2-hydroxybenzaldehyde SMILES: OC1=C(Br)C=CC=C1C=O
| PubChem CID | 10910555 |
|---|---|
| CAS | 1829-34-1 |
| Molecular Weight (g/mol) | 201.02 |
| MDL Number | MFCD00016587 |
| SMILES | OC1=C(Br)C=CC=C1C=O |
| IUPAC Name | 3-bromo-2-hydroxybenzaldehyde |
| InChI Key | STBGLXMINLWCNL-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO2 |
trans-2-Hexenal 97.0+%, TCI America™
CAS: 6728-26-3 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00007008 InChI Key: MBDOYVRWFFCFHM-SNAWJCMRSA-N Synonym: trans-2-hexenal,2-hexenal,leaf aldehyde,e-2-hexenal,e-hex-2-enal,2-trans-hexenal,beta-propyl acrolein,hexylenic aldehyde,hex-2-en-1-al,2-hexenal, e PubChem CID: 5281168 ChEBI: CHEBI:28913 IUPAC Name: (E)-hex-2-enal SMILES: CCCC=CC=O
| PubChem CID | 5281168 |
|---|---|
| CAS | 6728-26-3 |
| Molecular Weight (g/mol) | 98.145 |
| ChEBI | CHEBI:28913 |
| MDL Number | MFCD00007008 |
| SMILES | CCCC=CC=O |
| Synonym | trans-2-hexenal,2-hexenal,leaf aldehyde,e-2-hexenal,e-hex-2-enal,2-trans-hexenal,beta-propyl acrolein,hexylenic aldehyde,hex-2-en-1-al,2-hexenal, e |
| IUPAC Name | (E)-hex-2-enal |
| InChI Key | MBDOYVRWFFCFHM-SNAWJCMRSA-N |
| Molecular Formula | C6H10O |
1,4-Bis(2-hydroxyethoxy)-2-butyne 50.0+%, TCI America™
CAS: 1606-85-5 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.196 MDL Number: MFCD00002883 InChI Key: IXAWTPMDMPUGLV-UHFFFAOYSA-N Synonym: 1,4-bis 2-hydroxyethoxy-2-butyne,2-4-2-hydroxyethoxy but-2-ynoxy ethanol,unii-8tt85143cr,2,2'-but-2-yne-1,4-diylbis oxy diethanol,ethanol, 2,2'-2-butyne-1,4-diylbis oxy bis,2,2'-but-2-ynylenedioxydiethanol,ethanol, 2,2'-2-butynylenedioxy di,2,2'-2-butyne-1,4-diyldioxy diethanol,2,2'-2-butyne-1,4-diylbis oxy bisethanol,3,8-dioxa-5-decyne-1,10-diol PubChem CID: 62411 IUPAC Name: 2-[4-(2-hydroxyethoxy)but-2-ynoxy]ethanol SMILES: C(COCC#CCOCCO)O
| PubChem CID | 62411 |
|---|---|
| CAS | 1606-85-5 |
| Molecular Weight (g/mol) | 174.196 |
| MDL Number | MFCD00002883 |
| SMILES | C(COCC#CCOCCO)O |
| Synonym | 1,4-bis 2-hydroxyethoxy-2-butyne,2-4-2-hydroxyethoxy but-2-ynoxy ethanol,unii-8tt85143cr,2,2'-but-2-yne-1,4-diylbis oxy diethanol,ethanol, 2,2'-2-butyne-1,4-diylbis oxy bis,2,2'-but-2-ynylenedioxydiethanol,ethanol, 2,2'-2-butynylenedioxy di,2,2'-2-butyne-1,4-diyldioxy diethanol,2,2'-2-butyne-1,4-diylbis oxy bisethanol,3,8-dioxa-5-decyne-1,10-diol |
| IUPAC Name | 2-[4-(2-hydroxyethoxy)but-2-ynoxy]ethanol |
| InChI Key | IXAWTPMDMPUGLV-UHFFFAOYSA-N |
| Molecular Formula | C8H14O4 |
epi-Inositol 98.0+%, TCI America™
CAS: 488-58-4 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00077932,MFCD00065455,MFCD00003863,MFCD00272608,MFCD00799555,MFCD00799556,MFCD01321249 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: OC1C(O)C(O)C(O)C(O)C1O
| PubChem CID | 892 |
|---|---|
| CAS | 488-58-4 |
| Molecular Weight (g/mol) | 180.16 |
| ChEBI | CHEBI:24848 |
| MDL Number | MFCD00077932,MFCD00065455,MFCD00003863,MFCD00272608,MFCD00799555,MFCD00799556,MFCD01321249 |
| SMILES | OC1C(O)C(O)C(O)C(O)C1O |
| IUPAC Name | cyclohexane-1,2,3,4,5,6-hexol |
| InChI Key | CDAISMWEOUEBRE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O6 |