Organooxygen compounds
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Decahydro-2-naphthol (mixture of isomers) 95.0+%, TCI America™
CAS: 825-51-4 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00004132 InChI Key: UPMAOXLCTXPPAG-UHFFFAOYSA-N Synonym: 2-hydroxydecalin,2-decalol,2-naphthalenol, decahydro,decalin-2-ol,decahydronaphthalen-2-ol,2-decalinol,decahydro-2-naphthol,decahydronapthol-2,2-naphthol, decahydro,decahydronaphthol-2 PubChem CID: 13216 IUPAC Name: 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol SMILES: C1CCC2CC(CCC2C1)O
| PubChem CID | 13216 |
|---|---|
| CAS | 825-51-4 |
| Molecular Weight (g/mol) | 154.253 |
| MDL Number | MFCD00004132 |
| SMILES | C1CCC2CC(CCC2C1)O |
| Synonym | 2-hydroxydecalin,2-decalol,2-naphthalenol, decahydro,decalin-2-ol,decahydronaphthalen-2-ol,2-decalinol,decahydro-2-naphthol,decahydronapthol-2,2-naphthol, decahydro,decahydronaphthol-2 |
| IUPAC Name | 1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ol |
| InChI Key | UPMAOXLCTXPPAG-UHFFFAOYSA-N |
| Molecular Formula | C10H18O |
2,3-Dimethyl-2-hexanol 99.0+%, TCI America™
CAS: 19550-03-9 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00021806 InChI Key: BFKOEFFCVFMWPF-UHFFFAOYSA-N PubChem CID: 137270 IUPAC Name: 2,3-dimethylhexan-2-ol SMILES: CCCC(C)C(C)(C)O
| PubChem CID | 137270 |
|---|---|
| CAS | 19550-03-9 |
| Molecular Weight (g/mol) | 130.231 |
| MDL Number | MFCD00021806 |
| SMILES | CCCC(C)C(C)(C)O |
| IUPAC Name | 2,3-dimethylhexan-2-ol |
| InChI Key | BFKOEFFCVFMWPF-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
3-Decen-2-one 93.0+%, TCI America™
CAS: 10519-33-2 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00015700 InChI Key: JRPDANVNRUIUAB-CMDGGOBGSA-N Synonym: 3-decen-2-one,heptylidene acetone,oenanthylidene acetone,e-3-decen-2-one,unii-z22804bqxd,3e-dec-3-en-2-one,e-dec-3-en-2-one,dec-3-en-2-one,fema no. 3532,enanthylidene acetone PubChem CID: 5363233 IUPAC Name: (E)-dec-3-en-2-one SMILES: CCCCCCC=CC(=O)C
| PubChem CID | 5363233 |
|---|---|
| CAS | 10519-33-2 |
| Molecular Weight (g/mol) | 154.253 |
| MDL Number | MFCD00015700 |
| SMILES | CCCCCCC=CC(=O)C |
| Synonym | 3-decen-2-one,heptylidene acetone,oenanthylidene acetone,e-3-decen-2-one,unii-z22804bqxd,3e-dec-3-en-2-one,e-dec-3-en-2-one,dec-3-en-2-one,fema no. 3532,enanthylidene acetone |
| IUPAC Name | (E)-dec-3-en-2-one |
| InChI Key | JRPDANVNRUIUAB-CMDGGOBGSA-N |
| Molecular Formula | C10H18O |
Diethyl Methyloxalacetate 96.0+%, TCI America™
CAS: 759-65-9 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.206 MDL Number: MFCD00009163 InChI Key: OQOCQBJWOCRPQY-UHFFFAOYSA-N Synonym: Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate PubChem CID: 97750 ChEBI: CHEBI:16879 IUPAC Name: diethyl 2-methyl-3-oxobutanedioate SMILES: CCOC(=O)C(C)C(=O)C(=O)OCC
| PubChem CID | 97750 |
|---|---|
| CAS | 759-65-9 |
| Molecular Weight (g/mol) | 202.206 |
| ChEBI | CHEBI:16879 |
| MDL Number | MFCD00009163 |
| SMILES | CCOC(=O)C(C)C(=O)C(=O)OCC |
| Synonym | Methyloxalacetic Acid Diethyl Ester, 2-Ethoxalylpropionic Acid Ethyl Ester, Ethyl 2-Ethoxalylpropionate |
| IUPAC Name | diethyl 2-methyl-3-oxobutanedioate |
| InChI Key | OQOCQBJWOCRPQY-UHFFFAOYSA-N |
| Molecular Formula | C9H14O5 |
4,6-Diacetylresorcinol 98.0+%, TCI America™
CAS: 2161-85-5 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00017655 InChI Key: GEYCQLIOGQPPFM-UHFFFAOYSA-N Synonym: 4,6-diacetylresorcinol,resodiacetophenone,1,1'-4,6-dihydroxy-1,3-phenylene bisethanone,ethanone, 1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethanone,1,1'-4,6-dihydroxy-1,3-phenylene diethanone,1,3-diacetyl-4,6-dihydroxybenzene,ethanone,1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethan-1-one,1,1'-4,6-dihydroxy-1,3-phenylene-bis-ethanone PubChem CID: 75097 IUPAC Name: 1-(5-acetyl-2,4-dihydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC(C(C)=O)=C(O)C=C1O
| PubChem CID | 75097 |
|---|---|
| CAS | 2161-85-5 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD00017655 |
| SMILES | CC(=O)C1=CC(C(C)=O)=C(O)C=C1O |
| Synonym | 4,6-diacetylresorcinol,resodiacetophenone,1,1'-4,6-dihydroxy-1,3-phenylene bisethanone,ethanone, 1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethanone,1,1'-4,6-dihydroxy-1,3-phenylene diethanone,1,3-diacetyl-4,6-dihydroxybenzene,ethanone,1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethan-1-one,1,1'-4,6-dihydroxy-1,3-phenylene-bis-ethanone |
| IUPAC Name | 1-(5-acetyl-2,4-dihydroxyphenyl)ethan-1-one |
| InChI Key | GEYCQLIOGQPPFM-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
2',6'-Difluoroacetophenone 98.0+%, TCI America™
CAS: 13670-99-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00000328 InChI Key: VGIIILXIQLXVLC-UHFFFAOYSA-N Synonym: 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 PubChem CID: 83643 IUPAC Name: 1-(2,6-difluorophenyl)ethan-1-one SMILES: CC(=O)C1=C(F)C=CC=C1F
| PubChem CID | 83643 |
|---|---|
| CAS | 13670-99-0 |
| Molecular Weight (g/mol) | 156.13 |
| MDL Number | MFCD00000328 |
| SMILES | CC(=O)C1=C(F)C=CC=C1F |
| Synonym | 2',6'-difluoroacetophenone,1-2,6-difluorophenyl ethanone,2,6-difluoroacetophenone,1-2,6-difluorophenyl ethan-1-one,ethanone, 1-2,6-difluorophenyl,acetophenone, 2',6'-difluoro,1-acetyl-2,6-difluorobenzene,fr cf bv1,pubchem4218,intermediates-zcf02054 |
| IUPAC Name | 1-(2,6-difluorophenyl)ethan-1-one |
| InChI Key | VGIIILXIQLXVLC-UHFFFAOYSA-N |
| Molecular Formula | C8H6F2O |
4-Heptyloxybenzaldehyde 98.0+%, TCI America™
CAS: 27893-41-0 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 MDL Number: MFCD00016616 InChI Key: YBCKMIZXHKVONZ-UHFFFAOYSA-N Synonym: 4-heptyloxybenzaldehyde,4-heptyloxy benzaldehyde,p-heptyloxybenzaldehyde,4-n-heptyloxybenzaldehyde,benzaldehyde, 4-heptyloxy,p-heptyloxy benzaldehyde,4-n-heptoxybenzaldehyde,4-heptyloxy-benzaldehyde,p-n-heptoxybenzaldehyde,acmc-209gzj PubChem CID: 119740 IUPAC Name: 4-heptoxybenzaldehyde SMILES: CCCCCCCOC1=CC=C(C=C1)C=O
| PubChem CID | 119740 |
|---|---|
| CAS | 27893-41-0 |
| Molecular Weight (g/mol) | 220.312 |
| MDL Number | MFCD00016616 |
| SMILES | CCCCCCCOC1=CC=C(C=C1)C=O |
| Synonym | 4-heptyloxybenzaldehyde,4-heptyloxy benzaldehyde,p-heptyloxybenzaldehyde,4-n-heptyloxybenzaldehyde,benzaldehyde, 4-heptyloxy,p-heptyloxy benzaldehyde,4-n-heptoxybenzaldehyde,4-heptyloxy-benzaldehyde,p-n-heptoxybenzaldehyde,acmc-209gzj |
| IUPAC Name | 4-heptoxybenzaldehyde |
| InChI Key | YBCKMIZXHKVONZ-UHFFFAOYSA-N |
| Molecular Formula | C14H20O2 |
2-(o-Tolyl)ethanol 98.0+%, TCI America™
CAS: 19819-98-8 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00044241 InChI Key: RUGISKODRCWQNE-UHFFFAOYSA-N Synonym: 2-o-tolyl ethanol,2-methylphenethyl alcohol,2-2-methylphenyl ethanol,benzeneethanol, 2-methyl,o-methylphenethyl alcohol,phenethyl alcohol, o-methyl,2-methylbenzeneethanol,toluene-ethanol,unii-vx8700jgjp,2-2-methylphenyl ethan-1-ol PubChem CID: 88267 IUPAC Name: 2-(2-methylphenyl)ethanol SMILES: CC1=CC=CC=C1CCO
| PubChem CID | 88267 |
|---|---|
| CAS | 19819-98-8 |
| Molecular Weight (g/mol) | 136.194 |
| MDL Number | MFCD00044241 |
| SMILES | CC1=CC=CC=C1CCO |
| Synonym | 2-o-tolyl ethanol,2-methylphenethyl alcohol,2-2-methylphenyl ethanol,benzeneethanol, 2-methyl,o-methylphenethyl alcohol,phenethyl alcohol, o-methyl,2-methylbenzeneethanol,toluene-ethanol,unii-vx8700jgjp,2-2-methylphenyl ethan-1-ol |
| IUPAC Name | 2-(2-methylphenyl)ethanol |
| InChI Key | RUGISKODRCWQNE-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
4-(2-Hydroxyethoxy)benzaldehyde 98.0+%, TCI America™
CAS: 22042-73-5 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00191450 InChI Key: VCDGTEZSUNFOKA-UHFFFAOYSA-N PubChem CID: 89178 IUPAC Name: 4-(2-hydroxyethoxy)benzaldehyde SMILES: OCCOC1=CC=C(C=O)C=C1
| PubChem CID | 89178 |
|---|---|
| CAS | 22042-73-5 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00191450 |
| SMILES | OCCOC1=CC=C(C=O)C=C1 |
| IUPAC Name | 4-(2-hydroxyethoxy)benzaldehyde |
| InChI Key | VCDGTEZSUNFOKA-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
4'-Hydroxyheptanophenone 98.0+%, TCI America™
CAS: 14392-72-4 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.29 MDL Number: MFCD00191523 InChI Key: MAZPQHJYGKZQEA-UHFFFAOYSA-N Synonym: Hexyl 4-Hydroxyphenyl Ketone PubChem CID: 578426 IUPAC Name: 1-(4-hydroxyphenyl)heptan-1-one SMILES: CCCCCCC(=O)C1=CC=C(O)C=C1
| PubChem CID | 578426 |
|---|---|
| CAS | 14392-72-4 |
| Molecular Weight (g/mol) | 206.29 |
| MDL Number | MFCD00191523 |
| SMILES | CCCCCCC(=O)C1=CC=C(O)C=C1 |
| Synonym | Hexyl 4-Hydroxyphenyl Ketone |
| IUPAC Name | 1-(4-hydroxyphenyl)heptan-1-one |
| InChI Key | MAZPQHJYGKZQEA-UHFFFAOYSA-N |
| Molecular Formula | C13H18O2 |
2-Bromo-4'-methylpropiophenone 98.0+%, TCI America™
CAS: 1451-82-7 Molecular Formula: C10H11BrO Molecular Weight (g/mol): 227.10 MDL Number: MFCD11131402 InChI Key: OZLUPIIIHOOPNQ-UHFFFAOYNA-N Synonym: 2-bromo-1-p-tolyl propan-1-one,2-bromo-4'-methylpropiophenone,2-bromo-1-4-methylphenyl propan-1-one,2-bromo-4-methylpropiophenone,2-bromo-1-4-methylphenyl-1-propanone,1-propanone, 2-bromo-1-4-methylphenyl,2-bromo-1-p-tolylpropan-1-one,ksc917e0p,2-bromo-1-p-tolyl-propan-1-one,4'-methyl-alpha-bromopropiophenone PubChem CID: 2734063 IUPAC Name: 2-bromo-1-(4-methylphenyl)propan-1-one SMILES: CC(Br)C(=O)C1=CC=C(C)C=C1
| PubChem CID | 2734063 |
|---|---|
| CAS | 1451-82-7 |
| Molecular Weight (g/mol) | 227.10 |
| MDL Number | MFCD11131402 |
| SMILES | CC(Br)C(=O)C1=CC=C(C)C=C1 |
| Synonym | 2-bromo-1-p-tolyl propan-1-one,2-bromo-4'-methylpropiophenone,2-bromo-1-4-methylphenyl propan-1-one,2-bromo-4-methylpropiophenone,2-bromo-1-4-methylphenyl-1-propanone,1-propanone, 2-bromo-1-4-methylphenyl,2-bromo-1-p-tolylpropan-1-one,ksc917e0p,2-bromo-1-p-tolyl-propan-1-one,4'-methyl-alpha-bromopropiophenone |
| IUPAC Name | 2-bromo-1-(4-methylphenyl)propan-1-one |
| InChI Key | OZLUPIIIHOOPNQ-UHFFFAOYNA-N |
| Molecular Formula | C10H11BrO |
(S)-6,6'-Dibromo-2,2'-bis(methoxymethoxy)-1,1'-binaphthyl 98.0+%, TCI America™
CAS: 211560-97-3 Molecular Formula: C24H20Br2O4 Molecular Weight (g/mol): 532.228 MDL Number: MFCD03788936 InChI Key: UPLLZDVWXACTEG-UHFFFAOYSA-N PubChem CID: 10839989 IUPAC Name: 6-bromo-1-[6-bromo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene SMILES: COCOC1=C(C2=C(C=C1)C=C(C=C2)Br)C3=C(C=CC4=C3C=CC(=C4)Br)OCOC
| PubChem CID | 10839989 |
|---|---|
| CAS | 211560-97-3 |
| Molecular Weight (g/mol) | 532.228 |
| MDL Number | MFCD03788936 |
| SMILES | COCOC1=C(C2=C(C=C1)C=C(C=C2)Br)C3=C(C=CC4=C3C=CC(=C4)Br)OCOC |
| IUPAC Name | 6-bromo-1-[6-bromo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene |
| InChI Key | UPLLZDVWXACTEG-UHFFFAOYSA-N |
| Molecular Formula | C24H20Br2O4 |
Isovanillin 98.0+%, TCI America™
CAS: 621-59-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00003369 InChI Key: JVTZFYYHCGSXJV-UHFFFAOYSA-N Synonym: isovanillin,isovanilline,3-hydroxy-p-anisaldehyde,5-formylguaiacol,benzaldehyde, 3-hydroxy-4-methoxy,iso-vanillin,3-hydroxyanisaldehyde,isovanilin,isovanicaline,3-hydroxy-4-methoxy-benzaldehyde PubChem CID: 12127 IUPAC Name: 3-hydroxy-4-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)C=O)O
| PubChem CID | 12127 |
|---|---|
| CAS | 621-59-0 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00003369 |
| SMILES | COC1=C(C=C(C=C1)C=O)O |
| Synonym | isovanillin,isovanilline,3-hydroxy-p-anisaldehyde,5-formylguaiacol,benzaldehyde, 3-hydroxy-4-methoxy,iso-vanillin,3-hydroxyanisaldehyde,isovanilin,isovanicaline,3-hydroxy-4-methoxy-benzaldehyde |
| IUPAC Name | 3-hydroxy-4-methoxybenzaldehyde |
| InChI Key | JVTZFYYHCGSXJV-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Decaethylene Glycol 90.0+%, TCI America™
CAS: 5579-66-8 Molecular Formula: C20H42O11 Molecular Weight (g/mol): 458.545 MDL Number: MFCD00698693 InChI Key: DTPCFIHYWYONMD-UHFFFAOYSA-N PubChem CID: 79689 ChEBI: CHEBI:46550 IUPAC Name: 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCOCCOCCOCCOCCOCCO)O
| PubChem CID | 79689 |
|---|---|
| CAS | 5579-66-8 |
| Molecular Weight (g/mol) | 458.545 |
| ChEBI | CHEBI:46550 |
| MDL Number | MFCD00698693 |
| SMILES | C(COCCOCCOCCOCCOCCOCCOCCOCCOCCO)O |
| IUPAC Name | 2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | DTPCFIHYWYONMD-UHFFFAOYSA-N |
| Molecular Formula | C20H42O11 |
3-Acetylpyridine 98.0+%, TCI America™
CAS: 350-03-8 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006396 InChI Key: WEGYGNROSJDEIW-UHFFFAOYSA-N Synonym: 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one PubChem CID: 9589 IUPAC Name: 1-pyridin-3-ylethanone SMILES: CC(=O)C1=CN=CC=C1
| PubChem CID | 9589 |
|---|---|
| CAS | 350-03-8 |
| Molecular Weight (g/mol) | 121.139 |
| MDL Number | MFCD00006396 |
| SMILES | CC(=O)C1=CN=CC=C1 |
| Synonym | 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one |
| IUPAC Name | 1-pyridin-3-ylethanone |
| InChI Key | WEGYGNROSJDEIW-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |