Organooxygen compounds
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3-(Bromoacetyl)pyridine Hydrobromide 98.0+%, TCI America™
CAS: 17694-68-7 Molecular Formula: C7H7Br2NO Molecular Weight (g/mol): 280.95 MDL Number: MFCD00052182 InChI Key: WDTSYONULAZKIE-UHFFFAOYSA-N Synonym: 2-bromo-1-pyridin-3-yl ethanone hydrobromide,3-bromoacetyl pyridine hydrobromide,3-2-bromoacetyl pyridine hydrobromide,2-bromo-1-3-pyridinyl ethanone hydrobromide,3-bromoacetyl pyridinium bromide,3-bromoacetyl pyridine hbr,2-bromo-1-pyridin-3-ylethan-1-one hydrobromide,2-bromo-1-pyridin-3-ylethanone hydrobromide,3-bromoacetylpyridine hydrobromide PubChem CID: 2776234 IUPAC Name: hydrogen 2-bromo-1-(pyridin-3-yl)ethan-1-one bromide SMILES: [H+].[Br-].BrCC(=O)C1=CC=CN=C1
| PubChem CID | 2776234 |
|---|---|
| CAS | 17694-68-7 |
| Molecular Weight (g/mol) | 280.95 |
| MDL Number | MFCD00052182 |
| SMILES | [H+].[Br-].BrCC(=O)C1=CC=CN=C1 |
| Synonym | 2-bromo-1-pyridin-3-yl ethanone hydrobromide,3-bromoacetyl pyridine hydrobromide,3-2-bromoacetyl pyridine hydrobromide,2-bromo-1-3-pyridinyl ethanone hydrobromide,3-bromoacetyl pyridinium bromide,3-bromoacetyl pyridine hbr,2-bromo-1-pyridin-3-ylethan-1-one hydrobromide,2-bromo-1-pyridin-3-ylethanone hydrobromide,3-bromoacetylpyridine hydrobromide |
| IUPAC Name | hydrogen 2-bromo-1-(pyridin-3-yl)ethan-1-one bromide |
| InChI Key | WDTSYONULAZKIE-UHFFFAOYSA-N |
| Molecular Formula | C7H7Br2NO |
2-Chloro-4'-phenylacetophenone 99.0+%, TCI America™
CAS: 635-84-7 Molecular Formula: C14H11ClO Molecular Weight (g/mol): 230.69 MDL Number: MFCD00058937 InChI Key: IQEIGQFNDLINOT-UHFFFAOYSA-N Synonym: 4-Chloroacetylbiphenyl, 4-Phenylphenacyl Chloride PubChem CID: 69463 IUPAC Name: 1-{[1,1'-biphenyl]-4-yl}-2-chloroethan-1-one SMILES: ClCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1
| PubChem CID | 69463 |
|---|---|
| CAS | 635-84-7 |
| Molecular Weight (g/mol) | 230.69 |
| MDL Number | MFCD00058937 |
| SMILES | ClCC(=O)C1=CC=C(C=C1)C1=CC=CC=C1 |
| Synonym | 4-Chloroacetylbiphenyl, 4-Phenylphenacyl Chloride |
| IUPAC Name | 1-{[1,1'-biphenyl]-4-yl}-2-chloroethan-1-one |
| InChI Key | IQEIGQFNDLINOT-UHFFFAOYSA-N |
| Molecular Formula | C14H11ClO |
2,6-Dichlorobenzaldehyde 97.0+%, TCI America™
CAS: 83-38-5 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.008 MDL Number: MFCD00003307 InChI Key: DMIYKWPEFRFTPY-UHFFFAOYSA-N Synonym: benzaldehyde, 2,6-dichloro,ccris 6014,2,6-dichloro benzaldehyde,2,6-dichloro-benzaldehyde,2,6-dichloro-benzaldehyd,2,6-dichlorbenzaldehyd,pubchem8225,acmc-1bkey,2,6dichloro-benzaldehyde,benzaldehyde,6-dichloro PubChem CID: 6737 IUPAC Name: 2,6-dichlorobenzaldehyde SMILES: C1=CC(=C(C(=C1)Cl)C=O)Cl
| PubChem CID | 6737 |
|---|---|
| CAS | 83-38-5 |
| Molecular Weight (g/mol) | 175.008 |
| MDL Number | MFCD00003307 |
| SMILES | C1=CC(=C(C(=C1)Cl)C=O)Cl |
| Synonym | benzaldehyde, 2,6-dichloro,ccris 6014,2,6-dichloro benzaldehyde,2,6-dichloro-benzaldehyde,2,6-dichloro-benzaldehyd,2,6-dichlorbenzaldehyd,pubchem8225,acmc-1bkey,2,6dichloro-benzaldehyde,benzaldehyde,6-dichloro |
| IUPAC Name | 2,6-dichlorobenzaldehyde |
| InChI Key | DMIYKWPEFRFTPY-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O |
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 |
2-Bromo-4'-(methylsulfonyl)acetophenone 98.0+%, TCI America™
CAS: 50413-24-6 Molecular Formula: C9H9BrO3S Molecular Weight (g/mol): 277.13 MDL Number: MFCD00673134 InChI Key: JOCMYOUZIDSYFO-UHFFFAOYSA-N Synonym: 2-bromo-1-4-methylsulfonyl phenyl-1-ethanone,2-bromo-1-4-methylsulfonyl phenyl ethanone,4-methylsulfonyl alpha-bromoacetophenone,2-bromo-1-4-methylsulfonylphenyl ethanone,2-bromo-1-4-methanesulfonylphenyl ethan-1-one,2-bromo-4'-methylsulfonyl acetophenone,2-bromo-1-4-methanesulfonylphenyl ethanone,2-bromo-1-4-methanesulfonyl-phenyl-ethanone,ethanone, 2-bromo-1-4-methylsulfonyl phenyl PubChem CID: 735823 IUPAC Name: 2-bromo-1-(4-methanesulfonylphenyl)ethan-1-one SMILES: CS(=O)(=O)C1=CC=C(C=C1)C(=O)CBr
| PubChem CID | 735823 |
|---|---|
| CAS | 50413-24-6 |
| Molecular Weight (g/mol) | 277.13 |
| MDL Number | MFCD00673134 |
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)C(=O)CBr |
| Synonym | 2-bromo-1-4-methylsulfonyl phenyl-1-ethanone,2-bromo-1-4-methylsulfonyl phenyl ethanone,4-methylsulfonyl alpha-bromoacetophenone,2-bromo-1-4-methylsulfonylphenyl ethanone,2-bromo-1-4-methanesulfonylphenyl ethan-1-one,2-bromo-4'-methylsulfonyl acetophenone,2-bromo-1-4-methanesulfonylphenyl ethanone,2-bromo-1-4-methanesulfonyl-phenyl-ethanone,ethanone, 2-bromo-1-4-methylsulfonyl phenyl |
| IUPAC Name | 2-bromo-1-(4-methanesulfonylphenyl)ethan-1-one |
| InChI Key | JOCMYOUZIDSYFO-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO3S |
Trimethyl Orthoacetate 98.0+%, TCI America™
CAS: 1445-45-0 Molecular Formula: C5H12O3 Molecular Weight (g/mol): 120.148 MDL Number: MFCD00008477 InChI Key: HDPNBNXLBDFELL-UHFFFAOYSA-N Synonym: trimethyl orthoacetate,ethane, 1,1,1-trimethoxy,orthoacetic acid, trimethyl ester,methyl orthoacetate,orthoacetic acid trimethyl ester,ch3c och3 3,unii-04h7a3fk37,tmoa,trimethoxyethane,trimethyl-acetate PubChem CID: 15050 IUPAC Name: 1,1,1-trimethoxyethane SMILES: CC(OC)(OC)OC
| PubChem CID | 15050 |
|---|---|
| CAS | 1445-45-0 |
| Molecular Weight (g/mol) | 120.148 |
| MDL Number | MFCD00008477 |
| SMILES | CC(OC)(OC)OC |
| Synonym | trimethyl orthoacetate,ethane, 1,1,1-trimethoxy,orthoacetic acid, trimethyl ester,methyl orthoacetate,orthoacetic acid trimethyl ester,ch3c och3 3,unii-04h7a3fk37,tmoa,trimethoxyethane,trimethyl-acetate |
| IUPAC Name | 1,1,1-trimethoxyethane |
| InChI Key | HDPNBNXLBDFELL-UHFFFAOYSA-N |
| Molecular Formula | C5H12O3 |
1-Acenaphthenone 98.0+%, TCI America™
CAS: 2235-15-6 Molecular Formula: C12H8O Molecular Weight (g/mol): 168.195 MDL Number: MFCD00156651 InChI Key: JBXIOAKUBCTDES-UHFFFAOYSA-N PubChem CID: 75229 IUPAC Name: 2H-acenaphthylen-1-one SMILES: C1C2=CC=CC3=C2C(=CC=C3)C1=O
| PubChem CID | 75229 |
|---|---|
| CAS | 2235-15-6 |
| Molecular Weight (g/mol) | 168.195 |
| MDL Number | MFCD00156651 |
| SMILES | C1C2=CC=CC3=C2C(=CC=C3)C1=O |
| IUPAC Name | 2H-acenaphthylen-1-one |
| InChI Key | JBXIOAKUBCTDES-UHFFFAOYSA-N |
| Molecular Formula | C12H8O |
Propiophenone 98.0+%, TCI America™
CAS: 93-55-0 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00009309 InChI Key: KRIOVPPHQSLHCZ-UHFFFAOYSA-N Synonym: propiophenone,ethyl phenyl ketone,propionylbenzene,1-phenyl-1-propanone,1-propanone, 1-phenyl,phenyl ethyl ketone,ketone, ethyl phenyl,propionphenone,usaf ek-1235,1-phenyl-propan-1-one PubChem CID: 7148 ChEBI: CHEBI:425902 IUPAC Name: 1-phenylpropan-1-one SMILES: CCC(=O)C1=CC=CC=C1
| PubChem CID | 7148 |
|---|---|
| CAS | 93-55-0 |
| Molecular Weight (g/mol) | 134.178 |
| ChEBI | CHEBI:425902 |
| MDL Number | MFCD00009309 |
| SMILES | CCC(=O)C1=CC=CC=C1 |
| Synonym | propiophenone,ethyl phenyl ketone,propionylbenzene,1-phenyl-1-propanone,1-propanone, 1-phenyl,phenyl ethyl ketone,ketone, ethyl phenyl,propionphenone,usaf ek-1235,1-phenyl-propan-1-one |
| IUPAC Name | 1-phenylpropan-1-one |
| InChI Key | KRIOVPPHQSLHCZ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2-(2,6-Dichlorophenyl)ethanol 97.0+%, TCI America™
CAS: 30595-79-0 Molecular Formula: C8H8Cl2O Molecular Weight (g/mol): 191.05 MDL Number: MFCD00800674 InChI Key: ZBQPKQUIKJDGIX-UHFFFAOYSA-N Synonym: 2,6-dichlorophenethyl alcohol,2-2,6-dichlorophenyl ethanol,2,6-dichlorophenethylalcohol,2-2,6-dichlorophenyl ethan-1-ol,2,6-dichlorophenethanol,benzeneethanol, 2,6-dichloro,acmc-209hha,2,6-dichlorobenzeneethanol,ksc493m0h,benzeneethanol,2,6-dichloro PubChem CID: 2734100 IUPAC Name: 2-(2,6-dichlorophenyl)ethan-1-ol SMILES: OCCC1=C(Cl)C=CC=C1Cl
| PubChem CID | 2734100 |
|---|---|
| CAS | 30595-79-0 |
| Molecular Weight (g/mol) | 191.05 |
| MDL Number | MFCD00800674 |
| SMILES | OCCC1=C(Cl)C=CC=C1Cl |
| Synonym | 2,6-dichlorophenethyl alcohol,2-2,6-dichlorophenyl ethanol,2,6-dichlorophenethylalcohol,2-2,6-dichlorophenyl ethan-1-ol,2,6-dichlorophenethanol,benzeneethanol, 2,6-dichloro,acmc-209hha,2,6-dichlorobenzeneethanol,ksc493m0h,benzeneethanol,2,6-dichloro |
| IUPAC Name | 2-(2,6-dichlorophenyl)ethan-1-ol |
| InChI Key | ZBQPKQUIKJDGIX-UHFFFAOYSA-N |
| Molecular Formula | C8H8Cl2O |
Methyl 2-Oxocyclopentanecarboxylate 97.0+%, TCI America™
CAS: 10472-24-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00001411 InChI Key: PZBBESSUKAHBHD-UHFFFAOYSA-N Synonym: methyl 2-oxocyclopentanecarboxylate,methyl 2-cyclopentanonecarboxylate,2-carbmethoxycyclopentanone,methyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, methyl ester,2-methoxy carbonyl cyclopentanone,2-methoxycarbonylcyclopentanone,2-oxocyclopentanecarboxylic acid methyl ester,cyclopentanone-2-carboxylic acid methyl ester,mehyl-2-oxocyclopentane PubChem CID: 66328 IUPAC Name: methyl 2-oxocyclopentane-1-carboxylate SMILES: COC(=O)C1CCCC1=O
| PubChem CID | 66328 |
|---|---|
| CAS | 10472-24-9 |
| Molecular Weight (g/mol) | 142.154 |
| MDL Number | MFCD00001411 |
| SMILES | COC(=O)C1CCCC1=O |
| Synonym | methyl 2-oxocyclopentanecarboxylate,methyl 2-cyclopentanonecarboxylate,2-carbmethoxycyclopentanone,methyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, methyl ester,2-methoxy carbonyl cyclopentanone,2-methoxycarbonylcyclopentanone,2-oxocyclopentanecarboxylic acid methyl ester,cyclopentanone-2-carboxylic acid methyl ester,mehyl-2-oxocyclopentane |
| IUPAC Name | methyl 2-oxocyclopentane-1-carboxylate |
| InChI Key | PZBBESSUKAHBHD-UHFFFAOYSA-N |
| Molecular Formula | C7H10O3 |
(S)-2,2'-Dimethoxy-1,1'-binaphthyl 98.0+%, TCI America™
CAS: 75640-87-8 Molecular Formula: C22H18O2 Molecular Weight (g/mol): 314.384 MDL Number: MFCD00091146 InChI Key: BJAADAKPADTRCH-UHFFFAOYSA-N Synonym: (S)-1,1′C-Bi-2-naphthol Dimethyl Ether PubChem CID: 235616 IUPAC Name: 2-methoxy-1-(2-methoxynaphthalen-1-yl)naphthalene SMILES: COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC
| PubChem CID | 235616 |
|---|---|
| CAS | 75640-87-8 |
| Molecular Weight (g/mol) | 314.384 |
| MDL Number | MFCD00091146 |
| SMILES | COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC |
| Synonym | (S)-1,1′C-Bi-2-naphthol Dimethyl Ether |
| IUPAC Name | 2-methoxy-1-(2-methoxynaphthalen-1-yl)naphthalene |
| InChI Key | BJAADAKPADTRCH-UHFFFAOYSA-N |
| Molecular Formula | C22H18O2 |
3-Bromo-4-ethoxybenzaldehyde 97.0+%, TCI America™
CAS: 108373-05-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00672941 InChI Key: TZUUPGZANQRCHD-UHFFFAOYSA-N PubChem CID: 1494336 IUPAC Name: 3-bromo-4-ethoxybenzaldehyde SMILES: CCOC1=C(C=C(C=C1)C=O)Br
| PubChem CID | 1494336 |
|---|---|
| CAS | 108373-05-3 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00672941 |
| SMILES | CCOC1=C(C=C(C=C1)C=O)Br |
| IUPAC Name | 3-bromo-4-ethoxybenzaldehyde |
| InChI Key | TZUUPGZANQRCHD-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
Tributyl Orthoformate 95.0+%, TCI America™
CAS: 588-43-2 Molecular Formula: C13H28O3 Molecular Weight (g/mol): 232.364 MDL Number: MFCD00015250 InChI Key: SGJBIFUEFLWXJY-UHFFFAOYSA-N Synonym: tributyl orthoformate,1-dibutoxymethoxy butane,tri-n-butyl orthoformate,tributoxymethane,orthoformic acid butyl ester,orthoformic acid tributyl ester,orthoformic acid, tributyl ester,butane, 1,1',1-methylidynetris oxy tris,1,1',1-methylidynetris oxy tributane PubChem CID: 68521 IUPAC Name: 1-(dibutoxymethoxy)butane SMILES: CCCCOC(OCCCC)OCCCC
| PubChem CID | 68521 |
|---|---|
| CAS | 588-43-2 |
| Molecular Weight (g/mol) | 232.364 |
| MDL Number | MFCD00015250 |
| SMILES | CCCCOC(OCCCC)OCCCC |
| Synonym | tributyl orthoformate,1-dibutoxymethoxy butane,tri-n-butyl orthoformate,tributoxymethane,orthoformic acid butyl ester,orthoformic acid tributyl ester,orthoformic acid, tributyl ester,butane, 1,1',1-methylidynetris oxy tris,1,1',1-methylidynetris oxy tributane |
| IUPAC Name | 1-(dibutoxymethoxy)butane |
| InChI Key | SGJBIFUEFLWXJY-UHFFFAOYSA-N |
| Molecular Formula | C13H28O3 |
4-tert-Butylcyclohexanol (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 98-52-2 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.27 MDL Number: MFCD00001473,MFCD00064952,MFCD00070476 InChI Key: CCOQPGVQAWPUPE-UHFFFAOYSA-N Synonym: 4-tert-butylcyclohexanol,cis-4-tert-butylcyclohexanol,trans-4-tert-butylcyclohexanol,4-tert-butyl cyclohexanol,cis-4-tert-butyl cyclohexanol,padaryl,p-tert-butylcyclohexanol,cyclohexanol, 4-1,1-dimethylethyl,cyclohexanol, 4-tert-butyl,4-t-butylcyclohexanol PubChem CID: 7391 IUPAC Name: 4-tert-butylcyclohexan-1-ol SMILES: CC(C)(C)C1CCC(O)CC1
| PubChem CID | 7391 |
|---|---|
| CAS | 98-52-2 |
| Molecular Weight (g/mol) | 156.27 |
| MDL Number | MFCD00001473,MFCD00064952,MFCD00070476 |
| SMILES | CC(C)(C)C1CCC(O)CC1 |
| Synonym | 4-tert-butylcyclohexanol,cis-4-tert-butylcyclohexanol,trans-4-tert-butylcyclohexanol,4-tert-butyl cyclohexanol,cis-4-tert-butyl cyclohexanol,padaryl,p-tert-butylcyclohexanol,cyclohexanol, 4-1,1-dimethylethyl,cyclohexanol, 4-tert-butyl,4-t-butylcyclohexanol |
| IUPAC Name | 4-tert-butylcyclohexan-1-ol |
| InChI Key | CCOQPGVQAWPUPE-UHFFFAOYSA-N |
| Molecular Formula | C10H20O |
2-Chloro-4'-fluoroacetophenone 98.0+%, TCI America™
CAS: 456-04-2 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 InChI Key: UJZWJOQRSMOFMA-UHFFFAOYSA-N Synonym: 2-chloro-4'-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethanone,p-fluorophenacyl chloride,4-fluorophenacyl chloride,alpha-chloro-4-fluoroacetophenone,4-chloroacetyl-1-fluorobenzene,alpha-chloro-p-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethan-1-one,ethanone, 2-chloro-1-4-fluorophenyl,2'-chloro-4-fluoroacetophenone PubChem CID: 120248 IUPAC Name: 2-chloro-1-(4-fluorophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CCl)F
| PubChem CID | 120248 |
|---|---|
| CAS | 456-04-2 |
| Molecular Weight (g/mol) | 172.583 |
| SMILES | C1=CC(=CC=C1C(=O)CCl)F |
| Synonym | 2-chloro-4'-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethanone,p-fluorophenacyl chloride,4-fluorophenacyl chloride,alpha-chloro-4-fluoroacetophenone,4-chloroacetyl-1-fluorobenzene,alpha-chloro-p-fluoroacetophenone,2-chloro-1-4-fluorophenyl ethan-1-one,ethanone, 2-chloro-1-4-fluorophenyl,2'-chloro-4-fluoroacetophenone |
| IUPAC Name | 2-chloro-1-(4-fluorophenyl)ethanone |
| InChI Key | UJZWJOQRSMOFMA-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |