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Organooxygen compounds

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Alcohols and polyols (31)
Enediols (14)

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Isoamyl Alcohol (Clear, Colorless/Certified ACS), Fisher Chemical™

CAS: 123-51-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00002934 InChI Key: PHTQWCKDNZKARW-UHFFFAOYSA-N Synonym: 3-methyl-1-butanol,isoamyl alcohol,isopentyl alcohol,isopentanol,3-methylbutanol,1-butanol, 3-methyl,isoamylol,isobutylcarbinol,iso-amylalkohol,isobutyl carbinol PubChem CID: 31260 ChEBI: CHEBI:15837 IUPAC Name: 3-methylbutan-1-ol SMILES: CC(C)CCO

EDGE
PubChem CID 31260
CAS 123-51-3
Molecular Weight (g/mol) 88.15
ChEBI CHEBI:15837
MDL Number MFCD00002934
SMILES CC(C)CCO
Synonym 3-methyl-1-butanol,isoamyl alcohol,isopentyl alcohol,isopentanol,3-methylbutanol,1-butanol, 3-methyl,isoamylol,isobutylcarbinol,iso-amylalkohol,isobutyl carbinol
IUPAC Name 3-methylbutan-1-ol
InChI Key PHTQWCKDNZKARW-UHFFFAOYSA-N
Molecular Formula C5H12O
2

4'-Acetoxyacetophenone 98.0+%, TCI America™

CAS: 13031-43-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00017229 InChI Key: SMIOEQSLJNNKQF-UHFFFAOYSA-N Synonym: 4'-acetoxyacetophenone,p-acetoxyacetophenone,4-acetoxyacetophenone,p-acetylphenyl acetate,4-acetylphenyl acetate,unii-eo1xk390jf,ethanone, 1-4-acetyloxy phenyl,4-acetoxy acetophenone,4-acetoxy-acetophenone,eo1xk390jf PubChem CID: 83063 ChEBI: CHEBI:86558 IUPAC Name: 4-acetylphenyl acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C)=O

PubChem CID 83063
CAS 13031-43-1
Molecular Weight (g/mol) 178.19
ChEBI CHEBI:86558
MDL Number MFCD00017229
SMILES CC(=O)OC1=CC=C(C=C1)C(C)=O
Synonym 4'-acetoxyacetophenone,p-acetoxyacetophenone,4-acetoxyacetophenone,p-acetylphenyl acetate,4-acetylphenyl acetate,unii-eo1xk390jf,ethanone, 1-4-acetyloxy phenyl,4-acetoxy acetophenone,4-acetoxy-acetophenone,eo1xk390jf
IUPAC Name 4-acetylphenyl acetate
InChI Key SMIOEQSLJNNKQF-UHFFFAOYSA-N
Molecular Formula C10H10O3
3

Dyclonine Hydrochloride 98.0+%, TCI America™

CAS: 536-43-6 Molecular Formula: C18H28ClNO2 Molecular Weight (g/mol): 325.88 MDL Number: MFCD00035386 InChI Key: KNZADIMHVBBPOA-UHFFFAOYSA-N Synonym: dyclonine hydrochloride,dyclonine hcl,dyclone,dyclothane,tanaclone,4'-butoxy-3-piperidinopropiophenone hydrochloride,dyclocaine hydrochloride,unii-zec193879q,1-propanone, 1-4-butoxyphenyl-3-1-piperidinyl-, hydrochloride PubChem CID: 68304 ChEBI: CHEBI:4725 IUPAC Name: hydrogen 1-(4-butoxyphenyl)-3-(piperidin-1-yl)propan-1-one chloride SMILES: [H+].[Cl-].CCCCOC1=CC=C(C=C1)C(=O)CCN1CCCCC1

PubChem CID 68304
CAS 536-43-6
Molecular Weight (g/mol) 325.88
ChEBI CHEBI:4725
MDL Number MFCD00035386
SMILES [H+].[Cl-].CCCCOC1=CC=C(C=C1)C(=O)CCN1CCCCC1
Synonym dyclonine hydrochloride,dyclonine hcl,dyclone,dyclothane,tanaclone,4'-butoxy-3-piperidinopropiophenone hydrochloride,dyclocaine hydrochloride,unii-zec193879q,1-propanone, 1-4-butoxyphenyl-3-1-piperidinyl-, hydrochloride
IUPAC Name hydrogen 1-(4-butoxyphenyl)-3-(piperidin-1-yl)propan-1-one chloride
InChI Key KNZADIMHVBBPOA-UHFFFAOYSA-N
Molecular Formula C18H28ClNO2
4

cis,cis-9,12-Octadecadien-1-ol 95.0+%, TCI America™

CAS: 506-43-4 Molecular Formula: C18H34O Molecular Weight (g/mol): 266.47 MDL Number: MFCD00056667 InChI Key: JXNPEDYJTDQORS-HZJYTTRNSA-N Synonym: Linoleyl Alcohol PubChem CID: 5365682 ChEBI: CHEBI:73534 IUPAC Name: (9Z,12Z)-octadeca-9,12-dien-1-ol SMILES: CCCCC\C=C/C\C=C/CCCCCCCCO

PubChem CID 5365682
CAS 506-43-4
Molecular Weight (g/mol) 266.47
ChEBI CHEBI:73534
MDL Number MFCD00056667
SMILES CCCCC\C=C/C\C=C/CCCCCCCCO
Synonym Linoleyl Alcohol
IUPAC Name (9Z,12Z)-octadeca-9,12-dien-1-ol
InChI Key JXNPEDYJTDQORS-HZJYTTRNSA-N
Molecular Formula C18H34O
5

(S)-4-(2-Hydroxyethyl)-2,2-dimethyl-1,3-dioxolane 95.0+%, TCI America™

CAS: 32233-43-5 Molecular Formula: C7H14O3 Molecular Weight (g/mol): 146.186 MDL Number: MFCD02682967 InChI Key: YYEZYENJAMOWHW-ZCFIWIBFSA-N Synonym: (S)-2-(2,2-Dimethyl-1,3-dioxolan-4-yl)ethanol PubChem CID: 11480522 IUPAC Name: 2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol SMILES: CC1(OCC(O1)CCO)C

PubChem CID 11480522
CAS 32233-43-5
Molecular Weight (g/mol) 146.186
MDL Number MFCD02682967
SMILES CC1(OCC(O1)CCO)C
Synonym (S)-2-(2,2-Dimethyl-1,3-dioxolan-4-yl)ethanol
IUPAC Name 2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethanol
InChI Key YYEZYENJAMOWHW-ZCFIWIBFSA-N
Molecular Formula C7H14O3
6

Tris(2,4-pentanedionato)gallium(III) 97.0+%, TCI America™

CAS: 14405-43-7 Molecular Formula: C15H21GaO6 Molecular Weight (g/mol): 367.05 MDL Number: MFCD00013492 InChI Key: IMMRYVXLCAMRNK-UHFFFAOYSA-N Synonym: gallium iii acetylacetonate,gallium iii 2,4-pentanedionate PubChem CID: 71311502 IUPAC Name: gallium(3+) tris(2,4-dioxopentan-3-ide) SMILES: [Ga+3].CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O

PubChem CID 71311502
CAS 14405-43-7
Molecular Weight (g/mol) 367.05
MDL Number MFCD00013492
SMILES [Ga+3].CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O.CC(=O)[CH-]C(C)=O
Synonym gallium iii acetylacetonate,gallium iii 2,4-pentanedionate
IUPAC Name gallium(3+) tris(2,4-dioxopentan-3-ide)
InChI Key IMMRYVXLCAMRNK-UHFFFAOYSA-N
Molecular Formula C15H21GaO6
7

Chloramphenicol Palmitate 97.0+%, TCI America™

CAS: 530-43-8 Molecular Formula: C27H42Cl2N2O6 Molecular Weight (g/mol): 561.541 MDL Number: MFCD00083597 InChI Key: PXKHGMGELZGJQE-ILBGXUMGSA-N Synonym: D-(-)-threo-2-Dichloroacetamido-1-(4-nitrophenyl)-1,3-propanediol Palmitate, 2,2-Dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)-2-propyl]acetamide Palmitate PubChem CID: 443382 ChEBI: CHEBI:3605 IUPAC Name: [(2R,3R)-2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl] hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OCC(C(C1=CC=C(C=C1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl

PubChem CID 443382
CAS 530-43-8
Molecular Weight (g/mol) 561.541
ChEBI CHEBI:3605
MDL Number MFCD00083597
SMILES CCCCCCCCCCCCCCCC(=O)OCC(C(C1=CC=C(C=C1)[N+](=O)[O-])O)NC(=O)C(Cl)Cl
Synonym D-(-)-threo-2-Dichloroacetamido-1-(4-nitrophenyl)-1,3-propanediol Palmitate, 2,2-Dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)-2-propyl]acetamide Palmitate
IUPAC Name [(2R,3R)-2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl] hexadecanoate
InChI Key PXKHGMGELZGJQE-ILBGXUMGSA-N
Molecular Formula C27H42Cl2N2O6
8

1-Hydroxyanthraquinone 98.0+%, TCI America™

CAS: 129-43-1 Molecular Formula: C14H8O3 Molecular Weight (g/mol): 224.215 MDL Number: MFCD00058946 InChI Key: BTLXPCBPYBNQNR-UHFFFAOYSA-N PubChem CID: 8512 ChEBI: CHEBI:28877 IUPAC Name: 1-hydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O

PubChem CID 8512
CAS 129-43-1
Molecular Weight (g/mol) 224.215
ChEBI CHEBI:28877
MDL Number MFCD00058946
SMILES C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)O
IUPAC Name 1-hydroxyanthracene-9,10-dione
InChI Key BTLXPCBPYBNQNR-UHFFFAOYSA-N
Molecular Formula C14H8O3
9
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4'-Acetoxyacetophenone, 99%

CAS: 13031-43-1 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00017229 InChI Key: SMIOEQSLJNNKQF-UHFFFAOYSA-N Synonym: 4'-acetoxyacetophenone,p-acetoxyacetophenone,4-acetoxyacetophenone,p-acetylphenyl acetate,4-acetylphenyl acetate,unii-eo1xk390jf,ethanone, 1-4-acetyloxy phenyl,4-acetoxy acetophenone,4-acetoxy-acetophenone,eo1xk390jf PubChem CID: 83063 ChEBI: CHEBI:86558 IUPAC Name: (4-acetylphenyl) acetate SMILES: CC(=O)OC1=CC=C(C=C1)C(C)=O

PubChem CID 83063
CAS 13031-43-1
Molecular Weight (g/mol) 178.19
ChEBI CHEBI:86558
MDL Number MFCD00017229
SMILES CC(=O)OC1=CC=C(C=C1)C(C)=O
Synonym 4'-acetoxyacetophenone,p-acetoxyacetophenone,4-acetoxyacetophenone,p-acetylphenyl acetate,4-acetylphenyl acetate,unii-eo1xk390jf,ethanone, 1-4-acetyloxy phenyl,4-acetoxy acetophenone,4-acetoxy-acetophenone,eo1xk390jf
IUPAC Name (4-acetylphenyl) acetate
InChI Key SMIOEQSLJNNKQF-UHFFFAOYSA-N
Molecular Formula C10H10O3
10

4-Bromophenyl Cyclopropyl Ketone 95.0+%, TCI America™

CAS: 6952-89-2 Molecular Formula: C10H9BrO Molecular Weight (g/mol): 225.085 MDL Number: MFCD00019227 InChI Key: QTHHOINSCNBYQO-UHFFFAOYSA-N Synonym: 4-bromophenyl cyclopropyl methanone,4-bromophenyl cyclopropyl ketone,4-bromophenyl cyclopropylmethanone,methanone, 4-bromophenyl cyclopropyl,4-bromo-cyclopropylcarbonylbenzene,acmc-1bag8,4-bromobenzoyl cyclopropane,bromophenylcyclopropylmethanone PubChem CID: 81394 IUPAC Name: (4-bromophenyl)-cyclopropylmethanone SMILES: C1CC1C(=O)C2=CC=C(C=C2)Br

PubChem CID 81394
CAS 6952-89-2
Molecular Weight (g/mol) 225.085
MDL Number MFCD00019227
SMILES C1CC1C(=O)C2=CC=C(C=C2)Br
Synonym 4-bromophenyl cyclopropyl methanone,4-bromophenyl cyclopropyl ketone,4-bromophenyl cyclopropylmethanone,methanone, 4-bromophenyl cyclopropyl,4-bromo-cyclopropylcarbonylbenzene,acmc-1bag8,4-bromobenzoyl cyclopropane,bromophenylcyclopropylmethanone
IUPAC Name (4-bromophenyl)-cyclopropylmethanone
InChI Key QTHHOINSCNBYQO-UHFFFAOYSA-N
Molecular Formula C10H9BrO
11
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Ethyl 4-nitrophenylglyoxylate, 98+%

CAS: 70091-75-7 Molecular Formula: C10H9NO5 Molecular Weight (g/mol): 223.18 MDL Number: MFCD00051841 InChI Key: ZFCXKZCKJZFZGR-UHFFFAOYSA-N Synonym: ethyl 4-nitrophenylglyoxylate,ethyl 2-4-nitrophenyl-2-oxoacetate,ethyl 4-nitrobenzoylformate,ethyl 4-nitrophenyl oxo acetate,ethyl p-nitrophenylglyoxylate,ethyl-4-nitrophenylglyoxylate,ethyl 4-nitrophenyl oxo acetate #,4-nitrophenyloxoacetic acid ethyl ester,4-nitro-phenyl-oxo-acetic acid ethyl ester PubChem CID: 522372 IUPAC Name: ethyl 2-(4-nitrophenyl)-2-oxoacetate SMILES: CCOC(=O)C(=O)C1=CC=C(C=C1)[N+]([O-])=O

PubChem CID 522372
CAS 70091-75-7
Molecular Weight (g/mol) 223.18
MDL Number MFCD00051841
SMILES CCOC(=O)C(=O)C1=CC=C(C=C1)[N+]([O-])=O
Synonym ethyl 4-nitrophenylglyoxylate,ethyl 2-4-nitrophenyl-2-oxoacetate,ethyl 4-nitrobenzoylformate,ethyl 4-nitrophenyl oxo acetate,ethyl p-nitrophenylglyoxylate,ethyl-4-nitrophenylglyoxylate,ethyl 4-nitrophenyl oxo acetate #,4-nitrophenyloxoacetic acid ethyl ester,4-nitro-phenyl-oxo-acetic acid ethyl ester
IUPAC Name ethyl 2-(4-nitrophenyl)-2-oxoacetate
InChI Key ZFCXKZCKJZFZGR-UHFFFAOYSA-N
Molecular Formula C10H9NO5
12

4-Chromanol 98.0+%, TCI America™

CAS: 1481-93-2 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00006849 InChI Key: MGSHXMOLUWTMGP-UHFFFAOYSA-N Synonym: 4-chromanol,chroman-4-ol,3,4-dihydro-2h-1-benzopyran-4-ol,4-hydroxychroman,2h-1-benzopyran-4-ol, 3,4-dihydro,acmc-20mukj,3'-carboxy-alpha-chromanol,2h-1-benzopyran-4-ol,3,4-dihydro PubChem CID: 92890 IUPAC Name: 3,4-dihydro-2H-chromen-4-ol SMILES: C1COC2=CC=CC=C2C1O

PubChem CID 92890
CAS 1481-93-2
Molecular Weight (g/mol) 150.177
MDL Number MFCD00006849
SMILES C1COC2=CC=CC=C2C1O
Synonym 4-chromanol,chroman-4-ol,3,4-dihydro-2h-1-benzopyran-4-ol,4-hydroxychroman,2h-1-benzopyran-4-ol, 3,4-dihydro,acmc-20mukj,3'-carboxy-alpha-chromanol,2h-1-benzopyran-4-ol,3,4-dihydro
IUPAC Name 3,4-dihydro-2H-chromen-4-ol
InChI Key MGSHXMOLUWTMGP-UHFFFAOYSA-N
Molecular Formula C9H10O2
13

Propyl Ether 98.0+%, TCI America™

CAS: 111-43-3 Molecular Formula: C6H14O Molecular Weight (g/mol): 102.18 MDL Number: MFCD00009376 InChI Key: POLCUAVZOMRGSN-UHFFFAOYSA-N Synonym: dipropyl ether,propyl ether,n-propyl ether,di-n-propyl ether,propane, 1,1'-oxybis,dipropyl oxide,4-oxaheptane,ether, di-n-propyl,1,1'-oxybispropane,unii-42q250hs4g PubChem CID: 8114 IUPAC Name: 1-propoxypropane SMILES: CCCOCCC

PubChem CID 8114
CAS 111-43-3
Molecular Weight (g/mol) 102.18
MDL Number MFCD00009376
SMILES CCCOCCC
Synonym dipropyl ether,propyl ether,n-propyl ether,di-n-propyl ether,propane, 1,1'-oxybis,dipropyl oxide,4-oxaheptane,ether, di-n-propyl,1,1'-oxybispropane,unii-42q250hs4g
IUPAC Name 1-propoxypropane
InChI Key POLCUAVZOMRGSN-UHFFFAOYSA-N
Molecular Formula C6H14O
14

Allyl Methyl Ether 97.0+%, TCI America™

CAS: 627-40-7 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00008649 InChI Key: FASUFOTUSHAIHG-UHFFFAOYSA-N Synonym: allyl methyl ether,1-propene, 3-methoxy,3-methoxy-1-propene,ether, allyl methyl,3-methoxypropene,methyl allyl ether,allylmethylether,4-oxapent-1-ene,1-methoxy-2-propene,methylallyl ether PubChem CID: 69392 IUPAC Name: 3-methoxyprop-1-ene SMILES: COCC=C

PubChem CID 69392
CAS 627-40-7
Molecular Weight (g/mol) 72.11
MDL Number MFCD00008649
SMILES COCC=C
Synonym allyl methyl ether,1-propene, 3-methoxy,3-methoxy-1-propene,ether, allyl methyl,3-methoxypropene,methyl allyl ether,allylmethylether,4-oxapent-1-ene,1-methoxy-2-propene,methylallyl ether
IUPAC Name 3-methoxyprop-1-ene
InChI Key FASUFOTUSHAIHG-UHFFFAOYSA-N
Molecular Formula C4H8O
15

3,4-Dimethoxybenzaldehyde 98.0+%, TCI America™

CAS: 120-14-9 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00003363 InChI Key: WJUFSDZVCOTFON-UHFFFAOYSA-N Synonym: veratraldehyde,veratric aldehyde,methylvanillin,vanillin methyl ether,veratral,veratryl aldehyde,benzaldehyde, 3,4-dimethoxy,veratrum aldehyde,p-veratric aldehyde,4-o-methylvanillin PubChem CID: 8419 ChEBI: CHEBI:17098 IUPAC Name: 3,4-dimethoxybenzaldehyde SMILES: COC1=CC=C(C=O)C=C1OC

PubChem CID 8419
CAS 120-14-9
Molecular Weight (g/mol) 166.18
ChEBI CHEBI:17098
MDL Number MFCD00003363
SMILES COC1=CC=C(C=O)C=C1OC
Synonym veratraldehyde,veratric aldehyde,methylvanillin,vanillin methyl ether,veratral,veratryl aldehyde,benzaldehyde, 3,4-dimethoxy,veratrum aldehyde,p-veratric aldehyde,4-o-methylvanillin
IUPAC Name 3,4-dimethoxybenzaldehyde
InChI Key WJUFSDZVCOTFON-UHFFFAOYSA-N
Molecular Formula C9H10O3