Organooxygen compounds
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2-Ethylanthraquinone 98.0+%, TCI America™
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CAS: 84-51-5 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 MDL Number: MFCD00001237 InChI Key: SJEBAWHUJDUKQK-UHFFFAOYSA-N Synonym: 2-ethylanthraquinone,2-ethyl anthraquinone,2-ethyl-9,10-anthraquinone,anthraquinone, 2-ethyl,9,10-anthracenedione, 2-ethyl,usaf so-1,beta-ethylanthraquinone,unii-59yj81qzkd,59yj81qzkd,2-ethylanthra-9,10-quinone PubChem CID: 6772 IUPAC Name: 2-ethylanthracene-9,10-dione SMILES: CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O
| PubChem CID | 6772 |
|---|---|
| CAS | 84-51-5 |
| Molecular Weight (g/mol) | 236.27 |
| MDL Number | MFCD00001237 |
| SMILES | CCC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O |
| Synonym | 2-ethylanthraquinone,2-ethyl anthraquinone,2-ethyl-9,10-anthraquinone,anthraquinone, 2-ethyl,9,10-anthracenedione, 2-ethyl,usaf so-1,beta-ethylanthraquinone,unii-59yj81qzkd,59yj81qzkd,2-ethylanthra-9,10-quinone |
| IUPAC Name | 2-ethylanthracene-9,10-dione |
| InChI Key | SJEBAWHUJDUKQK-UHFFFAOYSA-N |
| Molecular Formula | C16H12O2 |
trans-1,2-Cyclohexanediol 99.0+%, TCI America™
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CAS: 1460-57-7 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00063611 InChI Key: PFURGBBHAOXLIO-PHDIDXHHSA-N Synonym: trans-1,2-cyclohexanediol,trans-cyclohexane-1,2-diol,1r,2r-cyclohexane-1,2-diol,1r,2r-trans-1,2-cyclohexanediol,1,2-cyclohexanediol, 1r,2r-rel,trans-1,2-dihydroxycyclohexane,1,2-cyclohexanediol, trans,l6tj aq bq&&trans,trans-1,2-cyclohexandiol,1r,2r-1,2-cyclohexanediol PubChem CID: 92886 ChEBI: CHEBI:16931 IUPAC Name: (1R,2R)-cyclohexane-1,2-diol SMILES: O[C@@H]1CCCC[C@H]1O
| PubChem CID | 92886 |
|---|---|
| CAS | 1460-57-7 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:16931 |
| MDL Number | MFCD00063611 |
| SMILES | O[C@@H]1CCCC[C@H]1O |
| Synonym | trans-1,2-cyclohexanediol,trans-cyclohexane-1,2-diol,1r,2r-cyclohexane-1,2-diol,1r,2r-trans-1,2-cyclohexanediol,1,2-cyclohexanediol, 1r,2r-rel,trans-1,2-dihydroxycyclohexane,1,2-cyclohexanediol, trans,l6tj aq bq&&trans,trans-1,2-cyclohexandiol,1r,2r-1,2-cyclohexanediol |
| IUPAC Name | (1R,2R)-cyclohexane-1,2-diol |
| InChI Key | PFURGBBHAOXLIO-PHDIDXHHSA-N |
| Molecular Formula | C6H12O2 |
3-Chloropropionaldehyde Dimethyl Acetal 93.0+%, TCI America™
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CAS: 35502-06-8 Molecular Formula: C5H11ClO2 Molecular Weight (g/mol): 138.591 MDL Number: MFCD16038653 InChI Key: DXWRNRRBDAQWDB-UHFFFAOYSA-N Synonym: 1-Chloro-3,3-dimethoxypropane PubChem CID: 142015 IUPAC Name: 3-chloro-1,1-dimethoxypropane SMILES: COC(CCCl)OC
| PubChem CID | 142015 |
|---|---|
| CAS | 35502-06-8 |
| Molecular Weight (g/mol) | 138.591 |
| MDL Number | MFCD16038653 |
| SMILES | COC(CCCl)OC |
| Synonym | 1-Chloro-3,3-dimethoxypropane |
| IUPAC Name | 3-chloro-1,1-dimethoxypropane |
| InChI Key | DXWRNRRBDAQWDB-UHFFFAOYSA-N |
| Molecular Formula | C5H11ClO2 |
1-Methoxyphenazine 97.0+%, TCI America™
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CAS: 2876-17-7 Molecular Formula: C13H10N2O Molecular Weight (g/mol): 210.236 MDL Number: MFCD01794656 InChI Key: ZYDGCYWJDWIJCS-UHFFFAOYSA-N PubChem CID: 76137 IUPAC Name: 1-methoxyphenazine SMILES: COC1=CC=CC2=NC3=CC=CC=C3N=C21
| PubChem CID | 76137 |
|---|---|
| CAS | 2876-17-7 |
| Molecular Weight (g/mol) | 210.236 |
| MDL Number | MFCD01794656 |
| SMILES | COC1=CC=CC2=NC3=CC=CC=C3N=C21 |
| IUPAC Name | 1-methoxyphenazine |
| InChI Key | ZYDGCYWJDWIJCS-UHFFFAOYSA-N |
| Molecular Formula | C13H10N2O |
2-Bromo-4-pyridinecarboxaldehyde 95.0+%, TCI America™
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CAS: 118289-17-1 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.008 MDL Number: MFCD04039311 InChI Key: RTWLIQFKXMWEJY-UHFFFAOYSA-N Synonym: 2-bromopyridine-4-carboxaldehyde,2-bromo-4-pyridinecarboxaldehyde,2-bromoisonicotinaldehyde,2-bromo-4-formylpyridine,2-bromo-4-pyridinecarbaldehyde,4-pyridinecarboxaldehyde, 2-bromo,2-bromopyridine-4-formylaldehyde,pubchem5075,2-bromisonicotinaldehyd,acmc-2099wk PubChem CID: 2762991 IUPAC Name: 2-bromopyridine-4-carbaldehyde SMILES: C1=CN=C(C=C1C=O)Br
| PubChem CID | 2762991 |
|---|---|
| CAS | 118289-17-1 |
| Molecular Weight (g/mol) | 186.008 |
| MDL Number | MFCD04039311 |
| SMILES | C1=CN=C(C=C1C=O)Br |
| Synonym | 2-bromopyridine-4-carboxaldehyde,2-bromo-4-pyridinecarboxaldehyde,2-bromoisonicotinaldehyde,2-bromo-4-formylpyridine,2-bromo-4-pyridinecarbaldehyde,4-pyridinecarboxaldehyde, 2-bromo,2-bromopyridine-4-formylaldehyde,pubchem5075,2-bromisonicotinaldehyd,acmc-2099wk |
| IUPAC Name | 2-bromopyridine-4-carbaldehyde |
| InChI Key | RTWLIQFKXMWEJY-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
1,3,5-Triacetylbenzene 98.0+%, TCI America™
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CAS: 779-90-8 Molecular Formula: C12H12O3 Molecular Weight (g/mol): 204.225 MDL Number: MFCD00008741 InChI Key: HSOAIPRTHLEQFI-UHFFFAOYSA-N Synonym: 1,3,5-triacetylbenzene,1,1',1-benzene-1,3,5-triyl triethanone,1,3,5,triacetylbenzene,benzene, 1,3,5-triacetyl,1-3,5-diacetylphenyl ethanone,1,5-triacetylbenzene,benzene,3,5-triacetyl,acmc-1bc4n,cambridge id 6741393,ethanone, 1,1',1-1,3,5-benzenetriyl tris PubChem CID: 69904 IUPAC Name: 1-(3,5-diacetylphenyl)ethanone SMILES: CC(=O)C1=CC(=CC(=C1)C(=O)C)C(=O)C
| PubChem CID | 69904 |
|---|---|
| CAS | 779-90-8 |
| Molecular Weight (g/mol) | 204.225 |
| MDL Number | MFCD00008741 |
| SMILES | CC(=O)C1=CC(=CC(=C1)C(=O)C)C(=O)C |
| Synonym | 1,3,5-triacetylbenzene,1,1',1-benzene-1,3,5-triyl triethanone,1,3,5,triacetylbenzene,benzene, 1,3,5-triacetyl,1-3,5-diacetylphenyl ethanone,1,5-triacetylbenzene,benzene,3,5-triacetyl,acmc-1bc4n,cambridge id 6741393,ethanone, 1,1',1-1,3,5-benzenetriyl tris |
| IUPAC Name | 1-(3,5-diacetylphenyl)ethanone |
| InChI Key | HSOAIPRTHLEQFI-UHFFFAOYSA-N |
| Molecular Formula | C12H12O3 |
Quinizarin 97.0+%, TCI America™
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CAS: 81-64-1 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001209 InChI Key: GUEIZVNYDFNHJU-UHFFFAOYSA-N Synonym: quinizarin,1,4-dihydroxyanthraquinone,quinizarine,chinizarin,solvent orange 86,1,4-dihydroxyanthrachinon,smoke orange r,1,4-dihydroxy-9,10-anthraquinone,macrolex orange gg,9,10-anthracenedione, 1,4-dihydroxy PubChem CID: 6688 ChEBI: CHEBI:37487 IUPAC Name: 1,4-dihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O
| PubChem CID | 6688 |
|---|---|
| CAS | 81-64-1 |
| Molecular Weight (g/mol) | 240.214 |
| ChEBI | CHEBI:37487 |
| MDL Number | MFCD00001209 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O |
| Synonym | quinizarin,1,4-dihydroxyanthraquinone,quinizarine,chinizarin,solvent orange 86,1,4-dihydroxyanthrachinon,smoke orange r,1,4-dihydroxy-9,10-anthraquinone,macrolex orange gg,9,10-anthracenedione, 1,4-dihydroxy |
| IUPAC Name | 1,4-dihydroxyanthracene-9,10-dione |
| InChI Key | GUEIZVNYDFNHJU-UHFFFAOYSA-N |
| Molecular Formula | C14H8O4 |
2-Bromo-2'-methylacetophenone 96.0+%, TCI America™
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CAS: 51012-65-8 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD04038955 InChI Key: XMGAXELQRATLJP-UHFFFAOYSA-N Synonym: 2-bromo-1-o-tolyl ethanone,2-bromo-1-2-methylphenyl ethan-1-one,2'-methylphenacyl bromide,2-bromo-1-o-tolylethanone,2-bromo-1-2-methylphenyl ethanone,2-methylphenacyl bromide,2-bromo-1-o-tolyl-ethanone,2-bromo-2'-methylacetophenone,ethanone, 2-bromo-1-methylphenyl,2-bromoacetyl toluene PubChem CID: 12430676 IUPAC Name: 2-bromo-1-(2-methylphenyl)ethanone SMILES: CC1=CC=CC=C1C(=O)CBr
| PubChem CID | 12430676 |
|---|---|
| CAS | 51012-65-8 |
| Molecular Weight (g/mol) | 213.074 |
| MDL Number | MFCD04038955 |
| SMILES | CC1=CC=CC=C1C(=O)CBr |
| Synonym | 2-bromo-1-o-tolyl ethanone,2-bromo-1-2-methylphenyl ethan-1-one,2'-methylphenacyl bromide,2-bromo-1-o-tolylethanone,2-bromo-1-2-methylphenyl ethanone,2-methylphenacyl bromide,2-bromo-1-o-tolyl-ethanone,2-bromo-2'-methylacetophenone,ethanone, 2-bromo-1-methylphenyl,2-bromoacetyl toluene |
| IUPAC Name | 2-bromo-1-(2-methylphenyl)ethanone |
| InChI Key | XMGAXELQRATLJP-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO |
2,2',4'-Trichloroacetophenone 98.0+%, TCI America™
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CAS: 4252-78-2 Molecular Formula: C8H5Cl3O Molecular Weight (g/mol): 223.477 MDL Number: MFCD00000934 InChI Key: VYWPPRLJNVHPEU-UHFFFAOYSA-N Synonym: 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one PubChem CID: 20250 IUPAC Name: 2-chloro-1-(2,4-dichlorophenyl)ethanone SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)CCl
| PubChem CID | 20250 |
|---|---|
| CAS | 4252-78-2 |
| Molecular Weight (g/mol) | 223.477 |
| MDL Number | MFCD00000934 |
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)CCl |
| Synonym | 2,2',4'-trichloroacetophenone,2-chloro-1-2,4-dichlorophenyl ethanone,2,4-dichlorophenacyl chloride,unii-2e35p7hji2,2-chloro-1-2,4-dichlorophenyl ethan-1-one,ccris 633,ethanone, 2-chloro-1-2,4-dichlorophenyl,2,2,4-trichloroacetophenone,dsstox_cid_6190,1-2,4-dichlorophenyl-2-chloroethan-1-one |
| IUPAC Name | 2-chloro-1-(2,4-dichlorophenyl)ethanone |
| InChI Key | VYWPPRLJNVHPEU-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl3O |
Capsanthin (=Paprika Extract) (Vegetable oil solution), TCI America™
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CAS: 465-42-9 Molecular Formula: C40H56O3 Molecular Weight (g/mol): 584.89 MDL Number: MFCD03423725 InChI Key: VYIRVAXUEZSDNC-RDJLEWNRSA-N Synonym: Paprika Extract PubChem CID: 5281228 ChEBI: CHEBI:3375 IUPAC Name: (2E,4E,6E,8E,10E,12E,14E,16E,18E)-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-19-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-4,8,13,17-tetramethylnonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one SMILES: C\C(\C=C\C=C(/C)\C=C\C(=O)[C@]1(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C
| PubChem CID | 5281228 |
|---|---|
| CAS | 465-42-9 |
| Molecular Weight (g/mol) | 584.89 |
| ChEBI | CHEBI:3375 |
| MDL Number | MFCD03423725 |
| SMILES | C\C(\C=C\C=C(/C)\C=C\C(=O)[C@]1(C)C[C@@H](O)CC1(C)C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(C)C[C@@H](O)CC1(C)C |
| Synonym | Paprika Extract |
| IUPAC Name | (2E,4E,6E,8E,10E,12E,14E,16E,18E)-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-19-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-4,8,13,17-tetramethylnonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one |
| InChI Key | VYIRVAXUEZSDNC-RDJLEWNRSA-N |
| Molecular Formula | C40H56O3 |
5-Bromo-3-pyridinemethanol 98.0+%, TCI America™
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CAS: 37669-64-0 Molecular Formula: C6H6BrNO Molecular Weight (g/mol): 188.02 MDL Number: MFCD03265757 InChI Key: WDVDHJLKXYCOFS-UHFFFAOYSA-N Synonym: 5-bromopyridin-3-yl methanol,5-bromo-3-pyridinemethanol,3-bromo-5-hydroxymethylpyridine,5-bromo-3-hydroxymethylpyridine,5-bromo-3-pyridinyl methanol,5-bromo-pyridin-3-yl-methanol,3-pyridinemethanol, 5-bromo,5-bromo-3-pyridyl methan-1-ol,3-bromo-5-hydroxymethyl pyridine,3-bromo-pyridin-5-yl methanol PubChem CID: 2784733 IUPAC Name: (5-bromopyridin-3-yl)methanol SMILES: OCC1=CC(Br)=CN=C1
| PubChem CID | 2784733 |
|---|---|
| CAS | 37669-64-0 |
| Molecular Weight (g/mol) | 188.02 |
| MDL Number | MFCD03265757 |
| SMILES | OCC1=CC(Br)=CN=C1 |
| Synonym | 5-bromopyridin-3-yl methanol,5-bromo-3-pyridinemethanol,3-bromo-5-hydroxymethylpyridine,5-bromo-3-hydroxymethylpyridine,5-bromo-3-pyridinyl methanol,5-bromo-pyridin-3-yl-methanol,3-pyridinemethanol, 5-bromo,5-bromo-3-pyridyl methan-1-ol,3-bromo-5-hydroxymethyl pyridine,3-bromo-pyridin-5-yl methanol |
| IUPAC Name | (5-bromopyridin-3-yl)methanol |
| InChI Key | WDVDHJLKXYCOFS-UHFFFAOYSA-N |
| Molecular Formula | C6H6BrNO |
2-(1-Naphthyl)ethanol 95.0+%, TCI America™
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CAS: 773-99-9 Molecular Formula: C12H12O Molecular Weight (g/mol): 172.227 MDL Number: MFCD00004050 InChI Key: RXWNCMHRJCOWDK-UHFFFAOYSA-N Synonym: 1-naphthaleneethanol,2-1-naphthyl ethanol,2-naphthalen-1-yl ethanol,1-2-hydroxyethyl naphthalene,naphthalen-1-ethanol,2-naphthylethanol,1-naphthyl ethanol,1-naphthalene ethanol,2-naphthalen-1-yl ethan-1-ol,1-napthaleneethanol PubChem CID: 13047 IUPAC Name: 2-naphthalen-1-ylethanol SMILES: C1=CC=C2C(=C1)C=CC=C2CCO
| PubChem CID | 13047 |
|---|---|
| CAS | 773-99-9 |
| Molecular Weight (g/mol) | 172.227 |
| MDL Number | MFCD00004050 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2CCO |
| Synonym | 1-naphthaleneethanol,2-1-naphthyl ethanol,2-naphthalen-1-yl ethanol,1-2-hydroxyethyl naphthalene,naphthalen-1-ethanol,2-naphthylethanol,1-naphthyl ethanol,1-naphthalene ethanol,2-naphthalen-1-yl ethan-1-ol,1-napthaleneethanol |
| IUPAC Name | 2-naphthalen-1-ylethanol |
| InChI Key | RXWNCMHRJCOWDK-UHFFFAOYSA-N |
| Molecular Formula | C12H12O |
6-Methoxyindole 98.0+%, TCI America™
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CAS: 3189-13-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00022780 InChI Key: QJRWYBIKLXNYLF-UHFFFAOYSA-N Synonym: 6-methoxyindole,1h-indole, 6-methoxy,indole, 6-methoxy,1h-indol-6-yl methyl ether,6-methoxy indole,pubchem1701,acmc-209hph,opera_id_1903,6-methyloxy-1h-indole PubChem CID: 76659 IUPAC Name: 6-methoxy-1H-indole SMILES: COC1=CC=C2C=CNC2=C1
| PubChem CID | 76659 |
|---|---|
| CAS | 3189-13-7 |
| Molecular Weight (g/mol) | 147.18 |
| MDL Number | MFCD00022780 |
| SMILES | COC1=CC=C2C=CNC2=C1 |
| Synonym | 6-methoxyindole,1h-indole, 6-methoxy,indole, 6-methoxy,1h-indol-6-yl methyl ether,6-methoxy indole,pubchem1701,acmc-209hph,opera_id_1903,6-methyloxy-1h-indole |
| IUPAC Name | 6-methoxy-1H-indole |
| InChI Key | QJRWYBIKLXNYLF-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
cis-1,3-Cyclohexanediol 98.0+%, TCI America™
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CAS: 823-18-7 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 InChI Key: RLMGYIOTPQVQJR-OLQVQODUSA-N Synonym: cis-1,3-Dihydroxycyclohexane PubChem CID: 6432741 IUPAC Name: (1S,3R)-cyclohexane-1,3-diol SMILES: C1CC(CC(C1)O)O
| PubChem CID | 6432741 |
|---|---|
| CAS | 823-18-7 |
| Molecular Weight (g/mol) | 116.16 |
| SMILES | C1CC(CC(C1)O)O |
| Synonym | cis-1,3-Dihydroxycyclohexane |
| IUPAC Name | (1S,3R)-cyclohexane-1,3-diol |
| InChI Key | RLMGYIOTPQVQJR-OLQVQODUSA-N |
| Molecular Formula | C6H12O2 |
Amyl Ether 98.0+%, TCI America™
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CAS: 693-65-2 Molecular Formula: C10H22O Molecular Weight (g/mol): 158.285 MDL Number: MFCD00009501 InChI Key: AOPDRZXCEAKHHW-UHFFFAOYSA-N Synonym: dipentyl ether,amyl ether,pentyl ether,n-amyl ether,diamyl ether,pentane, 1,1'-oxybis,n-pentyl ether,di-n-pentyl ether,pentyloxypentane,di-n-amyl ether PubChem CID: 12743 IUPAC Name: 1-pentoxypentane SMILES: CCCCCOCCCCC
| PubChem CID | 12743 |
|---|---|
| CAS | 693-65-2 |
| Molecular Weight (g/mol) | 158.285 |
| MDL Number | MFCD00009501 |
| SMILES | CCCCCOCCCCC |
| Synonym | dipentyl ether,amyl ether,pentyl ether,n-amyl ether,diamyl ether,pentane, 1,1'-oxybis,n-pentyl ether,di-n-pentyl ether,pentyloxypentane,di-n-amyl ether |
| IUPAC Name | 1-pentoxypentane |
| InChI Key | AOPDRZXCEAKHHW-UHFFFAOYSA-N |
| Molecular Formula | C10H22O |