Organooxygen compounds
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4,4'-Diacetylbiphenyl 99.0+%, TCI America™
CAS: 787-69-9 Molecular Formula: C16H14O2 Molecular Weight (g/mol): 238.286 MDL Number: MFCD00017248 InChI Key: YSTSBXDVNKYPTR-UHFFFAOYSA-N Synonym: 4,4'-diacetylbiphenyl,4,4'-diacetyl biphenyl,1-4-4-acetylphenyl phenyl ethanone,4,4-diacetylbiphenyl,1,1'-1,1'-biphenyl-4,4'-diyl diethanone,1-4'-acetyl 1,1'-biphenyl-4-yl ethanone,ethanone, 1,1'-1,1'-biphenyl-4,4'-diylbis,1-acetyl-4-4-acetylphenyl benzene,1-4'-acetyl-1,1'-biphenyl-4-yl ethanone,diacetyl biphenyl PubChem CID: 301558 IUPAC Name: 1-[4-(4-acetylphenyl)phenyl]ethanone SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C
| PubChem CID | 301558 |
|---|---|
| CAS | 787-69-9 |
| Molecular Weight (g/mol) | 238.286 |
| MDL Number | MFCD00017248 |
| SMILES | CC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C |
| Synonym | 4,4'-diacetylbiphenyl,4,4'-diacetyl biphenyl,1-4-4-acetylphenyl phenyl ethanone,4,4-diacetylbiphenyl,1,1'-1,1'-biphenyl-4,4'-diyl diethanone,1-4'-acetyl 1,1'-biphenyl-4-yl ethanone,ethanone, 1,1'-1,1'-biphenyl-4,4'-diylbis,1-acetyl-4-4-acetylphenyl benzene,1-4'-acetyl-1,1'-biphenyl-4-yl ethanone,diacetyl biphenyl |
| IUPAC Name | 1-[4-(4-acetylphenyl)phenyl]ethanone |
| InChI Key | YSTSBXDVNKYPTR-UHFFFAOYSA-N |
| Molecular Formula | C16H14O2 |
Jervine 97.0+%, TCI America™
CAS: 469-59-0 Molecular Formula: C27H39NO3 Molecular Weight (g/mol): 425.61 MDL Number: MFCD01684066 InChI Key: CLEXYFLHGFJONT-UHFFFAOYNA-N Synonym: jervine,iervin,jerwiny polish,11-ketocyclopamine,unii-19v3ecx465,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3beta,23beta,17,23beta-epoxy-3beta-hydroxyveratraman-11-one,spiro 9h-benzo a fluorene-9,2' 3'h-furo 3,2-b-pyridin-11 1h-one, 2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11a,11b-hexadecahydro-3-hydroxy-3',6',10, 11b-tetramethyl,jerwiny,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3-beta,23-beta PubChem CID: 10098 ChEBI: CHEBI:6088 IUPAC Name: 3-hydroxy-3',6',10,11b-tetramethyl-1,2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11,11a,11b-octadecahydro-3'H-spiro[cyclohexa[a]fluorene-9,2'-furo[3,2-b]pyridin]-11-one SMILES: CC1C2NCC(C)CC2OC11CCC2C3CC=C4CC(O)CCC4(C)C3C(=O)C2=C1C
| PubChem CID | 10098 |
|---|---|
| CAS | 469-59-0 |
| Molecular Weight (g/mol) | 425.61 |
| ChEBI | CHEBI:6088 |
| MDL Number | MFCD01684066 |
| SMILES | CC1C2NCC(C)CC2OC11CCC2C3CC=C4CC(O)CCC4(C)C3C(=O)C2=C1C |
| Synonym | jervine,iervin,jerwiny polish,11-ketocyclopamine,unii-19v3ecx465,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3beta,23beta,17,23beta-epoxy-3beta-hydroxyveratraman-11-one,spiro 9h-benzo a fluorene-9,2' 3'h-furo 3,2-b-pyridin-11 1h-one, 2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11a,11b-hexadecahydro-3-hydroxy-3',6',10, 11b-tetramethyl,jerwiny,veratraman-11-one, 17,23-epoxy-3-hydroxy-, 3-beta,23-beta |
| IUPAC Name | 3-hydroxy-3',6',10,11b-tetramethyl-1,2,3,3'a,4,4',5',6,6',6a,6b,7,7',7'a,8,11,11a,11b-octadecahydro-3'H-spiro[cyclohexa[a]fluorene-9,2'-furo[3,2-b]pyridin]-11-one |
| InChI Key | CLEXYFLHGFJONT-UHFFFAOYNA-N |
| Molecular Formula | C27H39NO3 |
Methyl Terephthalaldehydate 98.0+%, TCI America™
CAS: 1571-08-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00006950 InChI Key: FEIOASZZURHTHB-UHFFFAOYSA-N Synonym: methyl p-formylbenzoate,4-carbomethoxybenzaldehyde,methyl terephthalaldehydate,4-methoxycarbonyl benzaldehyde,benzoic acid, 4-formyl-, methyl ester,p-carbomethoxybenzaldehyde,methyl terephthaldehydate,methyl4-formylbenzoate,4-formylbenzoic acid methyl ester,methyl-p-formyl benzoate PubChem CID: 15294 IUPAC Name: methyl 4-formylbenzoate SMILES: COC(=O)C1=CC=C(C=O)C=C1
| PubChem CID | 15294 |
|---|---|
| CAS | 1571-08-0 |
| Molecular Weight (g/mol) | 164.16 |
| MDL Number | MFCD00006950 |
| SMILES | COC(=O)C1=CC=C(C=O)C=C1 |
| Synonym | methyl p-formylbenzoate,4-carbomethoxybenzaldehyde,methyl terephthalaldehydate,4-methoxycarbonyl benzaldehyde,benzoic acid, 4-formyl-, methyl ester,p-carbomethoxybenzaldehyde,methyl terephthaldehydate,methyl4-formylbenzoate,4-formylbenzoic acid methyl ester,methyl-p-formyl benzoate |
| IUPAC Name | methyl 4-formylbenzoate |
| InChI Key | FEIOASZZURHTHB-UHFFFAOYSA-N |
| Molecular Formula | C9H8O3 |
Chloromethyl Ethyl Ether 96.0+%, TCI America™
CAS: 3188-13-4 Molecular Formula: C3H7ClO Molecular Weight (g/mol): 94.54 MDL Number: MFCD00000887 InChI Key: FCYRSDMGOLYDHL-UHFFFAOYSA-N Synonym: chloromethyl ethyl ether,chloromethoxy ethane,ethane, chloromethoxy,chloromethylethylether,ethoxymethyl chloride,ethyl chloromethyl ether,ethoxychloromethane,ether, chloromethyl ethyl,ethoxy methyl chloride PubChem CID: 18523 IUPAC Name: (chloromethoxy)ethane SMILES: CCOCCl
| PubChem CID | 18523 |
|---|---|
| CAS | 3188-13-4 |
| Molecular Weight (g/mol) | 94.54 |
| MDL Number | MFCD00000887 |
| SMILES | CCOCCl |
| Synonym | chloromethyl ethyl ether,chloromethoxy ethane,ethane, chloromethoxy,chloromethylethylether,ethoxymethyl chloride,ethyl chloromethyl ether,ethoxychloromethane,ether, chloromethyl ethyl,ethoxy methyl chloride |
| IUPAC Name | (chloromethoxy)ethane |
| InChI Key | FCYRSDMGOLYDHL-UHFFFAOYSA-N |
| Molecular Formula | C3H7ClO |
Ethyl DL-Mandelate 95.0+%, TCI America™
CAS: 774-40-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00004494 InChI Key: SAXHIDRUJXPDOD-UHFFFAOYSA-N Synonym: ethyl mandelate,ethyl phenylglycolate,mandelic acid, ethyl ester,dl-mandelic acid ethyl ester,mandelic acid ethyl ester,ethyl dl-mandelate,mandelsaeureaethylester,ethyl hydroxy phenyl acetate,mandelsaeureaethylester german,+-ethyl mandelate PubChem CID: 13050 ChEBI: CHEBI:38750 IUPAC Name: ethyl 2-hydroxy-2-phenylacetate SMILES: CCOC(=O)C(C1=CC=CC=C1)O
| PubChem CID | 13050 |
|---|---|
| CAS | 774-40-3 |
| Molecular Weight (g/mol) | 180.203 |
| ChEBI | CHEBI:38750 |
| MDL Number | MFCD00004494 |
| SMILES | CCOC(=O)C(C1=CC=CC=C1)O |
| Synonym | ethyl mandelate,ethyl phenylglycolate,mandelic acid, ethyl ester,dl-mandelic acid ethyl ester,mandelic acid ethyl ester,ethyl dl-mandelate,mandelsaeureaethylester,ethyl hydroxy phenyl acetate,mandelsaeureaethylester german,+-ethyl mandelate |
| IUPAC Name | ethyl 2-hydroxy-2-phenylacetate |
| InChI Key | SAXHIDRUJXPDOD-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Propioin 95.0+%, TCI America™
CAS: 4984-85-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00043572 InChI Key: SKCYVGUCBRYGTE-UHFFFAOYSA-N Synonym: 4-Hydroxy-3-hexanone PubChem CID: 95609 ChEBI: CHEBI:18351 IUPAC Name: 4-hydroxyhexan-3-one SMILES: CCC(C(=O)CC)O
| PubChem CID | 95609 |
|---|---|
| CAS | 4984-85-4 |
| Molecular Weight (g/mol) | 116.16 |
| ChEBI | CHEBI:18351 |
| MDL Number | MFCD00043572 |
| SMILES | CCC(C(=O)CC)O |
| Synonym | 4-Hydroxy-3-hexanone |
| IUPAC Name | 4-hydroxyhexan-3-one |
| InChI Key | SKCYVGUCBRYGTE-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
3'-Methoxyphenacyl Bromide 99.0+%, TCI America™
CAS: 5000-65-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00000199 InChI Key: IOOHBIFQNQQUFI-UHFFFAOYSA-N Synonym: 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide PubChem CID: 101294 IUPAC Name: 2-bromo-1-(3-methoxyphenyl)ethanone SMILES: COC1=CC=CC(=C1)C(=O)CBr
| PubChem CID | 101294 |
|---|---|
| CAS | 5000-65-7 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00000199 |
| SMILES | COC1=CC=CC(=C1)C(=O)CBr |
| Synonym | 2-bromo-1-3-methoxyphenyl ethanone,2-bromo-3'-methoxyacetophenone,m-methoxyphenacyl bromide,3'-methoxyphenacyl bromide,3-bromoacetyl anisole,2-bromo-1-3-methoxyphenyl ethan-1-one,3-methoxyphenacyl bromide,bromomethyl 3-methoxyphenyl ketone,ccris 7998,3-methoxyphenacylbromide |
| IUPAC Name | 2-bromo-1-(3-methoxyphenyl)ethanone |
| InChI Key | IOOHBIFQNQQUFI-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
(2-Butoxyethoxy)acetic Acid 98.0+%, TCI America™
CAS: 82941-26-2 Molecular Formula: C8H16O4 Molecular Weight (g/mol): 176.21 MDL Number: MFCD01105178 InChI Key: OUINRTZUFNPIBX-UHFFFAOYSA-N Synonym: 3,6-Dioxadecanoic Acid PubChem CID: 106312 IUPAC Name: 2-butoxyethyl ethaneperoxoate SMILES: CCCCOCCOOC(C)=O
| PubChem CID | 106312 |
|---|---|
| CAS | 82941-26-2 |
| Molecular Weight (g/mol) | 176.21 |
| MDL Number | MFCD01105178 |
| SMILES | CCCCOCCOOC(C)=O |
| Synonym | 3,6-Dioxadecanoic Acid |
| IUPAC Name | 2-butoxyethyl ethaneperoxoate |
| InChI Key | OUINRTZUFNPIBX-UHFFFAOYSA-N |
| Molecular Formula | C8H16O4 |
trans-2-Octenal 96.0+%, TCI America™
CAS: 2548-87-0 Molecular Formula: C8H14O Molecular Weight (g/mol): 126.199 MDL Number: MFCD00007011 InChI Key: LVBXEMGDVWVTGY-VOTSOKGWSA-N Synonym: trans-2-octenal,e-oct-2-enal,e-2-octenal,2-octenal,trans-2-octen-1-al,e-2-octen-1-al,2-octen-1-al,2-octenel,2-octenal, e,2-octenal, 2e PubChem CID: 5283324 ChEBI: CHEBI:61748 IUPAC Name: (E)-oct-2-enal SMILES: CCCCCC=CC=O
| PubChem CID | 5283324 |
|---|---|
| CAS | 2548-87-0 |
| Molecular Weight (g/mol) | 126.199 |
| ChEBI | CHEBI:61748 |
| MDL Number | MFCD00007011 |
| SMILES | CCCCCC=CC=O |
| Synonym | trans-2-octenal,e-oct-2-enal,e-2-octenal,2-octenal,trans-2-octen-1-al,e-2-octen-1-al,2-octen-1-al,2-octenel,2-octenal, e,2-octenal, 2e |
| IUPAC Name | (E)-oct-2-enal |
| InChI Key | LVBXEMGDVWVTGY-VOTSOKGWSA-N |
| Molecular Formula | C8H14O |
n-Octyl Ether 96.0+%, TCI America™
CAS: 629-82-3 Molecular Formula: C16H34O Molecular Weight (g/mol): 242.447 MDL Number: MFCD00009563 InChI Key: NKJOXAZJBOMXID-UHFFFAOYSA-N Synonym: Di-n-octyl Ether PubChem CID: 12399 IUPAC Name: 1-octoxyoctane SMILES: CCCCCCCCOCCCCCCCC
| PubChem CID | 12399 |
|---|---|
| CAS | 629-82-3 |
| Molecular Weight (g/mol) | 242.447 |
| MDL Number | MFCD00009563 |
| SMILES | CCCCCCCCOCCCCCCCC |
| Synonym | Di-n-octyl Ether |
| IUPAC Name | 1-octoxyoctane |
| InChI Key | NKJOXAZJBOMXID-UHFFFAOYSA-N |
| Molecular Formula | C16H34O |
3-Ethyl-2-methyl-3-pentanol 98.0+%, TCI America™
CAS: 597-05-7 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.23 MDL Number: MFCD00046589 InChI Key: DMHIJUVUPKCGLJ-UHFFFAOYSA-N Synonym: 1,1-Diethylisobutyl Alcohol, Diethylisopropylcarbinol PubChem CID: 136390 IUPAC Name: 3-ethyl-2-methylpentan-3-ol SMILES: CCC(O)(CC)C(C)C
| PubChem CID | 136390 |
|---|---|
| CAS | 597-05-7 |
| Molecular Weight (g/mol) | 130.23 |
| MDL Number | MFCD00046589 |
| SMILES | CCC(O)(CC)C(C)C |
| Synonym | 1,1-Diethylisobutyl Alcohol, Diethylisopropylcarbinol |
| IUPAC Name | 3-ethyl-2-methylpentan-3-ol |
| InChI Key | DMHIJUVUPKCGLJ-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
3-Methoxypropylamine 99.0+%, TCI America™
CAS: 5332-73-0 Molecular Formula: C4H11NO Molecular Weight (g/mol): 89.14 MDL Number: MFCD00014831 InChI Key: FAXDZWQIWUSWJH-UHFFFAOYSA-N Synonym: 3-methoxypropylamine,1-propanamine, 3-methoxy,1-amino-3-methoxypropane,3-aminopropyl methyl ether,3-methyoxypropylamine,3-methoxy-n-propylamine,3-methoxy-1-propanamine,propylamine, 3-methoxy,3-mpa,propanolamine methyl ether PubChem CID: 1672 IUPAC Name: 3-methoxypropan-1-amine SMILES: COCCCN
| PubChem CID | 1672 |
|---|---|
| CAS | 5332-73-0 |
| Molecular Weight (g/mol) | 89.14 |
| MDL Number | MFCD00014831 |
| SMILES | COCCCN |
| Synonym | 3-methoxypropylamine,1-propanamine, 3-methoxy,1-amino-3-methoxypropane,3-aminopropyl methyl ether,3-methyoxypropylamine,3-methoxy-n-propylamine,3-methoxy-1-propanamine,propylamine, 3-methoxy,3-mpa,propanolamine methyl ether |
| IUPAC Name | 3-methoxypropan-1-amine |
| InChI Key | FAXDZWQIWUSWJH-UHFFFAOYSA-N |
| Molecular Formula | C4H11NO |
2-Chloromethyl-1,3-dioxolane 95.0+%, TCI America™
CAS: 2568-30-1 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.548 MDL Number: MFCD00043402 InChI Key: IKZOMJGRWIOEDP-UHFFFAOYSA-N PubChem CID: 75727 IUPAC Name: 2-(chloromethyl)-1,3-dioxolane SMILES: C1COC(O1)CCl
| PubChem CID | 75727 |
|---|---|
| CAS | 2568-30-1 |
| Molecular Weight (g/mol) | 122.548 |
| MDL Number | MFCD00043402 |
| SMILES | C1COC(O1)CCl |
| IUPAC Name | 2-(chloromethyl)-1,3-dioxolane |
| InChI Key | IKZOMJGRWIOEDP-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO2 |
4-Ethoxybenzaldehyde 98.0+%, TCI America™
CAS: 10031-82-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00003388 InChI Key: JRHHJNMASOIRDS-UHFFFAOYSA-N Synonym: benzaldehyde, 4-ethoxy,p-ethoxybenzaldehyde,ethoxybenzaldehyde,benzaldehyde, p-ethoxy,homoanisaldehyde,4-ethyloxy benzaldehyde,unii-gow1h0f49a,fema no. 2413,4-ethoxy-benzaldehyde,ethoxybenzaldehyde, p PubChem CID: 24834 IUPAC Name: 4-ethoxybenzaldehyde SMILES: CCOC1=CC=C(C=O)C=C1
| PubChem CID | 24834 |
|---|---|
| CAS | 10031-82-0 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00003388 |
| SMILES | CCOC1=CC=C(C=O)C=C1 |
| Synonym | benzaldehyde, 4-ethoxy,p-ethoxybenzaldehyde,ethoxybenzaldehyde,benzaldehyde, p-ethoxy,homoanisaldehyde,4-ethyloxy benzaldehyde,unii-gow1h0f49a,fema no. 2413,4-ethoxy-benzaldehyde,ethoxybenzaldehyde, p |
| IUPAC Name | 4-ethoxybenzaldehyde |
| InChI Key | JRHHJNMASOIRDS-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
NU 2058 98.0+%, TCI America™
CAS: 161058-83-9 Molecular Formula: C12H17N5O Molecular Weight (g/mol): 247.302 MDL Number: MFCD05664734 InChI Key: MWGXGTJJAOZBNW-UHFFFAOYSA-N Synonym: 6-cyclohexylmethoxy-9h-purin-2-amine,6-o-cyclohexylmethyl guanine,2-amino-6-cyclohexylmethoxypurine,2-amino-6-cyclohexylmethyl oxy purine,6-cyclohexylmethoxy-7h-purin-2-amine,9h-purin-2-amine, 6-cyclohexylmethoxy,o-cyclohexylmethylguanine,o6-cyclohexylmethylguanine,d0r1ft,d0sj6y PubChem CID: 4564 IUPAC Name: 6-(cyclohexylmethoxy)-7H-purin-2-amine SMILES: C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)N
| PubChem CID | 4564 |
|---|---|
| CAS | 161058-83-9 |
| Molecular Weight (g/mol) | 247.302 |
| MDL Number | MFCD05664734 |
| SMILES | C1CCC(CC1)COC2=NC(=NC3=C2NC=N3)N |
| Synonym | 6-cyclohexylmethoxy-9h-purin-2-amine,6-o-cyclohexylmethyl guanine,2-amino-6-cyclohexylmethoxypurine,2-amino-6-cyclohexylmethyl oxy purine,6-cyclohexylmethoxy-7h-purin-2-amine,9h-purin-2-amine, 6-cyclohexylmethoxy,o-cyclohexylmethylguanine,o6-cyclohexylmethylguanine,d0r1ft,d0sj6y |
| IUPAC Name | 6-(cyclohexylmethoxy)-7H-purin-2-amine |
| InChI Key | MWGXGTJJAOZBNW-UHFFFAOYSA-N |
| Molecular Formula | C12H17N5O |