Organooxygen compounds
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Hexaethylene Glycol 98.0+%, TCI America™
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CAS: 2615-15-8 Molecular Formula: C12H26O7 Molecular Weight (g/mol): 282.333 MDL Number: MFCD00002877 InChI Key: IIRDTKBZINWQAW-UHFFFAOYSA-N Synonym: hexaethylene glycol,hexagol,3,6,9,12,15-pentaoxaheptadecane-1,17-diol,hexaoxyethylene glycol,peg-6,polyethylene glycol 300,polyoxyethylene 6,hexaethyleneglycol,2-2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethoxy ethanol,ho-peg6-oh PubChem CID: 17472 ChEBI: CHEBI:49793 IUPAC Name: 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol SMILES: C(COCCOCCOCCOCCOCCO)O
| PubChem CID | 17472 |
|---|---|
| CAS | 2615-15-8 |
| Molecular Weight (g/mol) | 282.333 |
| ChEBI | CHEBI:49793 |
| MDL Number | MFCD00002877 |
| SMILES | C(COCCOCCOCCOCCOCCO)O |
| Synonym | hexaethylene glycol,hexagol,3,6,9,12,15-pentaoxaheptadecane-1,17-diol,hexaoxyethylene glycol,peg-6,polyethylene glycol 300,polyoxyethylene 6,hexaethyleneglycol,2-2-2-2-2-2-hydroxyethoxy ethoxy ethoxy ethoxy ethoxy ethanol,ho-peg6-oh |
| IUPAC Name | 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol |
| InChI Key | IIRDTKBZINWQAW-UHFFFAOYSA-N |
| Molecular Formula | C12H26O7 |
3-Methylthiophene-2-carboxaldehyde 85.0+%, TCI America™
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CAS: 5834-16-2 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.173 MDL Number: MFCD00005430 InChI Key: BSQKBHXYEKVKMN-UHFFFAOYSA-N Synonym: 3-methyl-2-thiophenecarboxaldehyde,3-methylthiophene-2-carboxaldehyde,2-formyl-3-methylthiophene,3-methylthiophene-2-aldehyde,3-methyl-2-thiophenecarbaldehyde,3-methyl-2-formylthiophene,3-methyl-2-thiophene carboxaldehyde,2-thiophenecarboxaldehyde, 3-methyl,thiophenecarboxaldehyde, methyl,3-methyl-thiophene-2-carbaldehyde PubChem CID: 79911 IUPAC Name: 3-methylthiophene-2-carbaldehyde SMILES: CC1=C(SC=C1)C=O
| PubChem CID | 79911 |
|---|---|
| CAS | 5834-16-2 |
| Molecular Weight (g/mol) | 126.173 |
| MDL Number | MFCD00005430 |
| SMILES | CC1=C(SC=C1)C=O |
| Synonym | 3-methyl-2-thiophenecarboxaldehyde,3-methylthiophene-2-carboxaldehyde,2-formyl-3-methylthiophene,3-methylthiophene-2-aldehyde,3-methyl-2-thiophenecarbaldehyde,3-methyl-2-formylthiophene,3-methyl-2-thiophene carboxaldehyde,2-thiophenecarboxaldehyde, 3-methyl,thiophenecarboxaldehyde, methyl,3-methyl-thiophene-2-carbaldehyde |
| IUPAC Name | 3-methylthiophene-2-carbaldehyde |
| InChI Key | BSQKBHXYEKVKMN-UHFFFAOYSA-N |
| Molecular Formula | C6H6OS |
4-Ethoxy-2-butanone 92.0+%, TCI America™
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CAS: 60044-74-8 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00059372 InChI Key: YFBGSHHKHHCVDI-UHFFFAOYSA-N PubChem CID: 536145 IUPAC Name: 4-ethoxybutan-2-one SMILES: CCOCCC(=O)C
| PubChem CID | 536145 |
|---|---|
| CAS | 60044-74-8 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00059372 |
| SMILES | CCOCCC(=O)C |
| IUPAC Name | 4-ethoxybutan-2-one |
| InChI Key | YFBGSHHKHHCVDI-UHFFFAOYSA-N |
| Molecular Formula | C6H12O2 |
2,5,8,11,14-Pentaoxaheptadec-16-yne 98.0+%, TCI America™
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CAS: 1101668-39-6 Molecular Formula: C12H22O5 Molecular Weight (g/mol): 246.30 MDL Number: MFCD28155212 InChI Key: QOXHTXZSGABRDF-UHFFFAOYSA-N Synonym: mPEG4-Alkyne PubChem CID: 86291528 IUPAC Name: 2,5,8,11,14-pentaoxaheptadec-16-yne SMILES: COCCOCCOCCOCCOCC#C
| PubChem CID | 86291528 |
|---|---|
| CAS | 1101668-39-6 |
| Molecular Weight (g/mol) | 246.30 |
| MDL Number | MFCD28155212 |
| SMILES | COCCOCCOCCOCCOCC#C |
| Synonym | mPEG4-Alkyne |
| IUPAC Name | 2,5,8,11,14-pentaoxaheptadec-16-yne |
| InChI Key | QOXHTXZSGABRDF-UHFFFAOYSA-N |
| Molecular Formula | C12H22O5 |
5-Benzoylpentanoic Acid 98.0+%, TCI America™
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CAS: 4144-62-1 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.24 MDL Number: MFCD00014380 InChI Key: AIEMSTCGCMIJTI-UHFFFAOYSA-N Synonym: 5-benzoylpentanoic acid,5-benzoylvaleric acid,delta-benzoylvaleric acid,5-benzoylpentanoicacid,6-benzoylpentanoic acid,acmc-1akf8,6-oxo-6-phenyl-hexanoic acid,6-oxo-6-phenyl hexanoic acid,6-keto-6-phenyl-hexanoic acid PubChem CID: 223595 IUPAC Name: 6-oxo-6-phenylhexanoic acid SMILES: OC(=O)CCCCC(=O)C1=CC=CC=C1
| PubChem CID | 223595 |
|---|---|
| CAS | 4144-62-1 |
| Molecular Weight (g/mol) | 206.24 |
| MDL Number | MFCD00014380 |
| SMILES | OC(=O)CCCCC(=O)C1=CC=CC=C1 |
| Synonym | 5-benzoylpentanoic acid,5-benzoylvaleric acid,delta-benzoylvaleric acid,5-benzoylpentanoicacid,6-benzoylpentanoic acid,acmc-1akf8,6-oxo-6-phenyl-hexanoic acid,6-oxo-6-phenyl hexanoic acid,6-keto-6-phenyl-hexanoic acid |
| IUPAC Name | 6-oxo-6-phenylhexanoic acid |
| InChI Key | AIEMSTCGCMIJTI-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |
Tris(dibenzylideneacetone)dipalladium(0) 75.0+%, TCI America™
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CAS: 51364-51-3 Molecular Formula: C51H42O3Pd2 Molecular Weight (g/mol): 915.73 MDL Number: MFCD00013310 InChI Key: CYPYTURSJDMMMP-UHFFFAOYSA-N Synonym: tris dibenzylideneacetone dipalladium 0,tris dibenzylideneacetone dipalladium,pd2 dba 3,tris dibezylideneacetone dipalladium,tris dibenzylideneacetone dipalladium o,tris dibenzylideneacetonyl bis-palladium,tris dba,tris 1e,4e-1,5-diphenylpenta-1,4-dien-3-one dipalladium PubChem CID: 9811564 IUPAC Name: tris(1,5-diphenylpenta-1,4-dien-3-one) dipalladium SMILES: [Pd].[Pd].O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1
| PubChem CID | 9811564 |
|---|---|
| CAS | 51364-51-3 |
| Molecular Weight (g/mol) | 915.73 |
| MDL Number | MFCD00013310 |
| SMILES | [Pd].[Pd].O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1.O=C(C=CC1=CC=CC=C1)C=CC1=CC=CC=C1 |
| Synonym | tris dibenzylideneacetone dipalladium 0,tris dibenzylideneacetone dipalladium,pd2 dba 3,tris dibezylideneacetone dipalladium,tris dibenzylideneacetone dipalladium o,tris dibenzylideneacetonyl bis-palladium,tris dba,tris 1e,4e-1,5-diphenylpenta-1,4-dien-3-one dipalladium |
| IUPAC Name | tris(1,5-diphenylpenta-1,4-dien-3-one) dipalladium |
| InChI Key | CYPYTURSJDMMMP-UHFFFAOYSA-N |
| Molecular Formula | C51H42O3Pd2 |
4-Chloroisatin 97.0+%, TCI America™
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CAS: 6344-05-4 Molecular Formula: C8H4ClNO2 Molecular Weight (g/mol): 181.58 InChI Key: HSYFISNDMZKGRS-UHFFFAOYSA-N Synonym: 4-Chloroindole-2,3-dione, 4-Chloro-2,3-indolinedione PubChem CID: 96047 IUPAC Name: 4-chloro-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)Cl)C(=O)C(=O)N2
| PubChem CID | 96047 |
|---|---|
| CAS | 6344-05-4 |
| Molecular Weight (g/mol) | 181.58 |
| SMILES | C1=CC2=C(C(=C1)Cl)C(=O)C(=O)N2 |
| Synonym | 4-Chloroindole-2,3-dione, 4-Chloro-2,3-indolinedione |
| IUPAC Name | 4-chloro-1H-indole-2,3-dione |
| InChI Key | HSYFISNDMZKGRS-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClNO2 |
trans-2-Heptenal 95.0+%, TCI America™
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CAS: 18829-55-5 Molecular Formula: C7H12O Molecular Weight (g/mol): 112.172 MDL Number: MFCD00007010 InChI Key: NDFKTBCGKNOHPJ-AATRIKPKSA-N Synonym: e-hept-2-enal,trans-2-heptenal,2-heptenal,butylacrolein,3-butylacrolein,2-heptenal, e,e-2-hepten-1-al,2-heptenal, 2e,beta-butylacrolein,trans-2-hepten-1-al PubChem CID: 5283316 IUPAC Name: (E)-hept-2-enal SMILES: CCCCC=CC=O
| PubChem CID | 5283316 |
|---|---|
| CAS | 18829-55-5 |
| Molecular Weight (g/mol) | 112.172 |
| MDL Number | MFCD00007010 |
| SMILES | CCCCC=CC=O |
| Synonym | e-hept-2-enal,trans-2-heptenal,2-heptenal,butylacrolein,3-butylacrolein,2-heptenal, e,e-2-hepten-1-al,2-heptenal, 2e,beta-butylacrolein,trans-2-hepten-1-al |
| IUPAC Name | (E)-hept-2-enal |
| InChI Key | NDFKTBCGKNOHPJ-AATRIKPKSA-N |
| Molecular Formula | C7H12O |
4'-Chloro-2'-hydroxyacetophenone 96.0+%, TCI America™
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CAS: 6921-66-0 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00238557 InChI Key: QCVSDCHNBNFJDQ-UHFFFAOYSA-N PubChem CID: 1051513 IUPAC Name: 1-(4-chloro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)Cl)O
| PubChem CID | 1051513 |
|---|---|
| CAS | 6921-66-0 |
| Molecular Weight (g/mol) | 170.592 |
| MDL Number | MFCD00238557 |
| SMILES | CC(=O)C1=C(C=C(C=C1)Cl)O |
| IUPAC Name | 1-(4-chloro-2-hydroxyphenyl)ethanone |
| InChI Key | QCVSDCHNBNFJDQ-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
4,4'-Difluorobenzil 98.0+%, TCI America™
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CAS: 579-39-5 Molecular Formula: C14H8F2O2 Molecular Weight (g/mol): 246.213 MDL Number: MFCD00134541 InChI Key: BRKULQOUSCHDGS-UHFFFAOYSA-N Synonym: 4,4'-difluorobenzil,1,2-bis 4-fluorophenyl ethane-1,2-dione,ethanedione, bis 4-fluorophenyl,4,4'-difluorodibenzoyl,1,2-ethanedione, 1,2-bis 4-fluorophenyl,bis 4-fluorophenyl ethane-1,2-dione,difluorobenzil,4,4'difluorobenzil,pubchem7683,acmc-1aylx PubChem CID: 123072 IUPAC Name: 1,2-bis(4-fluorophenyl)ethane-1,2-dione SMILES: C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)F)F
| PubChem CID | 123072 |
|---|---|
| CAS | 579-39-5 |
| Molecular Weight (g/mol) | 246.213 |
| MDL Number | MFCD00134541 |
| SMILES | C1=CC(=CC=C1C(=O)C(=O)C2=CC=C(C=C2)F)F |
| Synonym | 4,4'-difluorobenzil,1,2-bis 4-fluorophenyl ethane-1,2-dione,ethanedione, bis 4-fluorophenyl,4,4'-difluorodibenzoyl,1,2-ethanedione, 1,2-bis 4-fluorophenyl,bis 4-fluorophenyl ethane-1,2-dione,difluorobenzil,4,4'difluorobenzil,pubchem7683,acmc-1aylx |
| IUPAC Name | 1,2-bis(4-fluorophenyl)ethane-1,2-dione |
| InChI Key | BRKULQOUSCHDGS-UHFFFAOYSA-N |
| Molecular Formula | C14H8F2O2 |
3,5-Dichlorosalicylaldehyde 98.0+%, TCI America™
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CAS: 90-60-8 Molecular Formula: C7H4Cl2O2 Molecular Weight (g/mol): 191.007 MDL Number: MFCD00003320 InChI Key: FABVMBDCVAJXMB-UHFFFAOYSA-N Synonym: 3,5-dichlorosalicylaldehyde,benzaldehyde, 3,5-dichloro-2-hydroxy,2-hydroxy-3,5-dichlorobenzaldehyde,3,5-dichloro salicylal,salicylaldehyde, 3,5-dichloro,3,5-dichloro-2-hydroxy-benzaldehyde,pubchem8246,timtec-bb sbb003642,acmc-209r6w,salicylaldehyde,5-dichloro PubChem CID: 66660 IUPAC Name: 3,5-dichloro-2-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1Cl)O)C=O)Cl
| PubChem CID | 66660 |
|---|---|
| CAS | 90-60-8 |
| Molecular Weight (g/mol) | 191.007 |
| MDL Number | MFCD00003320 |
| SMILES | C1=C(C=C(C(=C1Cl)O)C=O)Cl |
| Synonym | 3,5-dichlorosalicylaldehyde,benzaldehyde, 3,5-dichloro-2-hydroxy,2-hydroxy-3,5-dichlorobenzaldehyde,3,5-dichloro salicylal,salicylaldehyde, 3,5-dichloro,3,5-dichloro-2-hydroxy-benzaldehyde,pubchem8246,timtec-bb sbb003642,acmc-209r6w,salicylaldehyde,5-dichloro |
| IUPAC Name | 3,5-dichloro-2-hydroxybenzaldehyde |
| InChI Key | FABVMBDCVAJXMB-UHFFFAOYSA-N |
| Molecular Formula | C7H4Cl2O2 |
Allyl n-Octyl Ether 95.0+%, TCI America™
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CAS: 3295-97-4 Molecular Formula: C11H22O Molecular Weight (g/mol): 170.296 MDL Number: MFCD00015294 InChI Key: IELYMBBIHQDONA-UHFFFAOYSA-N PubChem CID: 520600 IUPAC Name: 1-prop-2-enoxyoctane SMILES: CCCCCCCCOCC=C
| PubChem CID | 520600 |
|---|---|
| CAS | 3295-97-4 |
| Molecular Weight (g/mol) | 170.296 |
| MDL Number | MFCD00015294 |
| SMILES | CCCCCCCCOCC=C |
| IUPAC Name | 1-prop-2-enoxyoctane |
| InChI Key | IELYMBBIHQDONA-UHFFFAOYSA-N |
| Molecular Formula | C11H22O |
Isobutyrophenone 98.0+%, TCI America™
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CAS: 611-70-1 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00008917 InChI Key: BSMGLVDZZMBWQB-UHFFFAOYSA-N Synonym: isobutyrophenone,isopropyl phenyl ketone,2-methylpropiophenone,1-propanone, 2-methyl-1-phenyl,phenyl isopropyl ketone,isopropyl phenyl keton,alpha-methylpropiophenone,unii-8l53972ntz,.alpha.-methylpropiophenone,2-methyl-1-phenyl-1-propanone PubChem CID: 69144 IUPAC Name: 2-methyl-1-phenylpropan-1-one SMILES: CC(C)C(=O)C1=CC=CC=C1
| PubChem CID | 69144 |
|---|---|
| CAS | 611-70-1 |
| Molecular Weight (g/mol) | 148.21 |
| MDL Number | MFCD00008917 |
| SMILES | CC(C)C(=O)C1=CC=CC=C1 |
| Synonym | isobutyrophenone,isopropyl phenyl ketone,2-methylpropiophenone,1-propanone, 2-methyl-1-phenyl,phenyl isopropyl ketone,isopropyl phenyl keton,alpha-methylpropiophenone,unii-8l53972ntz,.alpha.-methylpropiophenone,2-methyl-1-phenyl-1-propanone |
| IUPAC Name | 2-methyl-1-phenylpropan-1-one |
| InChI Key | BSMGLVDZZMBWQB-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
2-(Hydroxymethyl)-15-crown 5-Ether 96.0+%, TCI America™
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CAS: 75507-25-4 Molecular Formula: C11H22O6 Molecular Weight (g/mol): 250.291 MDL Number: MFCD00192215 InChI Key: YHIQMMGCRYKJLB-UHFFFAOYSA-N PubChem CID: 2733744 IUPAC Name: 1,4,7,10,13-pentaoxacyclopentadec-2-ylmethanol SMILES: C1COCCOCC(OCCOCCO1)CO
| PubChem CID | 2733744 |
|---|---|
| CAS | 75507-25-4 |
| Molecular Weight (g/mol) | 250.291 |
| MDL Number | MFCD00192215 |
| SMILES | C1COCCOCC(OCCOCCO1)CO |
| IUPAC Name | 1,4,7,10,13-pentaoxacyclopentadec-2-ylmethanol |
| InChI Key | YHIQMMGCRYKJLB-UHFFFAOYSA-N |
| Molecular Formula | C11H22O6 |
5-(1,3-Dioxolan-2-yl)-2-furaldehyde 95.0+%, TCI America™
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CAS: 117953-13-6 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00671521 InChI Key: XTPZCGOSUHCSQZ-UHFFFAOYSA-N Synonym: 5-(1,3-Dioxolan-2-yl)furfural PubChem CID: 14616597 IUPAC Name: 5-(1,3-dioxolan-2-yl)furan-2-carbaldehyde SMILES: O=CC1=CC=C(O1)C1OCCO1
| PubChem CID | 14616597 |
|---|---|
| CAS | 117953-13-6 |
| Molecular Weight (g/mol) | 168.15 |
| MDL Number | MFCD00671521 |
| SMILES | O=CC1=CC=C(O1)C1OCCO1 |
| Synonym | 5-(1,3-Dioxolan-2-yl)furfural |
| IUPAC Name | 5-(1,3-dioxolan-2-yl)furan-2-carbaldehyde |
| InChI Key | XTPZCGOSUHCSQZ-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |