
Organooxygen compounds
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Thiazole-5-methanol, 95%, Thermo Scientific™
CAS: 38585-74-9 Molecular Formula: C4H5NOS Molecular Weight (g/mol): 115.15 InChI Key: WKBQQWDVVHGWDB-UHFFFAOYSA-N Synonym: 5-hydroxymethylthiazole,5-hydroxymethyl thiazole,thiazol-5-ylmethanol,5-thiazolemethanol,thiazole-5-methanol,thiazol-5-yl-methanol,thiazol-5-yl methanol,5-thiazolylmethanol,5-hydroxymethyl-1,3-thiazole PubChem CID: 2763216 IUPAC Name: 1,3-thiazol-5-ylmethanol SMILES: C1=C(SC=N1)CO

PubChem CID | 2763216 |
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CAS | 38585-74-9 |
Molecular Weight (g/mol) | 115.15 |
SMILES | C1=C(SC=N1)CO |
Synonym | 5-hydroxymethylthiazole,5-hydroxymethyl thiazole,thiazol-5-ylmethanol,5-thiazolemethanol,thiazole-5-methanol,thiazol-5-yl-methanol,thiazol-5-yl methanol,5-thiazolylmethanol,5-hydroxymethyl-1,3-thiazole |
IUPAC Name | 1,3-thiazol-5-ylmethanol |
InChI Key | WKBQQWDVVHGWDB-UHFFFAOYSA-N |
Molecular Formula | C4H5NOS |
Boron trifluoride dibutyl etherate, 30-35%, (BF3), AcroSeal™
CAS: 593-04-4 Molecular Formula: C8H18BF3O Molecular Weight (g/mol): 198.04 MDL Number: MFCD00013195 InChI Key: PVKVBDZRILNPJY-UHFFFAOYSA-N Synonym: 1-butoxybutane; trifluoroborane,boron trifluoride dibutyl etherate,boron trifluoride-butyl ether complex,boron, trifluoro 1,1'-oxybis butane-, t-4,boron trifluoride; di-n-butyl ether,1-butoxybutane-trifluoroborane 1:1,1-butoxybutane; tris fluoranyl borane,trifluoro 1,1'-oxybis butane boron PubChem CID: 68970 IUPAC Name: 1-butoxybutane;trifluoroborane SMILES: FB(F)F.CCCCOCCCC

PubChem CID | 68970 |
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CAS | 593-04-4 |
Molecular Weight (g/mol) | 198.04 |
MDL Number | MFCD00013195 |
SMILES | FB(F)F.CCCCOCCCC |
Synonym | 1-butoxybutane; trifluoroborane,boron trifluoride dibutyl etherate,boron trifluoride-butyl ether complex,boron, trifluoro 1,1'-oxybis butane-, t-4,boron trifluoride; di-n-butyl ether,1-butoxybutane-trifluoroborane 1:1,1-butoxybutane; tris fluoranyl borane,trifluoro 1,1'-oxybis butane boron |
IUPAC Name | 1-butoxybutane;trifluoroborane |
InChI Key | PVKVBDZRILNPJY-UHFFFAOYSA-N |
Molecular Formula | C8H18BF3O |
2',6'-Dichloroacetophenone, 97%, Thermo Scientific Chemicals
CAS: 2040-05-3 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00016339 InChI Key: HYBDSXBLGCQKRE-UHFFFAOYSA-N Synonym: 2',6'-dichloroacetophenone,1-2,6-dichlorophenyl ethanone,2,6-dichloroacetophenone,1-2,6-dichlorophenyl ethan-1-one,ethanone, 1-2,6-dichlorophenyl,2,6-dichloro acetophenone,1-acetyl-2,6-dichlorobenzene,zlchem 1084,pubchem12362,acmc-1cobf PubChem CID: 74877 IUPAC Name: 1-(2,6-dichlorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC=C1Cl)Cl

PubChem CID | 74877 |
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CAS | 2040-05-3 |
Molecular Weight (g/mol) | 189.04 |
MDL Number | MFCD00016339 |
SMILES | CC(=O)C1=C(C=CC=C1Cl)Cl |
Synonym | 2',6'-dichloroacetophenone,1-2,6-dichlorophenyl ethanone,2,6-dichloroacetophenone,1-2,6-dichlorophenyl ethan-1-one,ethanone, 1-2,6-dichlorophenyl,2,6-dichloro acetophenone,1-acetyl-2,6-dichlorobenzene,zlchem 1084,pubchem12362,acmc-1cobf |
IUPAC Name | 1-(2,6-dichlorophenyl)ethanone |
InChI Key | HYBDSXBLGCQKRE-UHFFFAOYSA-N |
Molecular Formula | C8H6Cl2O |
Methyl 4-(1-hydroxyethyl)benzoate, 90%, tech.
CAS: 79322-76-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.2 MDL Number: MFCD00216476 InChI Key: KAXLTAULVFFCNL-UHFFFAOYSA-N PubChem CID: 586417 IUPAC Name: methyl 4-(1-hydroxyethyl)benzoate SMILES: CC(C1=CC=C(C=C1)C(=O)OC)O

PubChem CID | 586417 |
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CAS | 79322-76-2 |
Molecular Weight (g/mol) | 180.2 |
MDL Number | MFCD00216476 |
SMILES | CC(C1=CC=C(C=C1)C(=O)OC)O |
IUPAC Name | methyl 4-(1-hydroxyethyl)benzoate |
InChI Key | KAXLTAULVFFCNL-UHFFFAOYSA-N |
Molecular Formula | C10H12O3 |
3-Pentyn-1-ol, 99%
CAS: 10229-10-4 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.12 MDL Number: MFCD00002956 InChI Key: IDYNOORNKYEHHO-UHFFFAOYSA-N Synonym: 3-pentyn-1-ol,3-pentynol,acmc-1bxad PubChem CID: 66295 IUPAC Name: pent-3-yn-1-ol SMILES: CC#CCCO

PubChem CID | 66295 |
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CAS | 10229-10-4 |
Molecular Weight (g/mol) | 84.12 |
MDL Number | MFCD00002956 |
SMILES | CC#CCCO |
Synonym | 3-pentyn-1-ol,3-pentynol,acmc-1bxad |
IUPAC Name | pent-3-yn-1-ol |
InChI Key | IDYNOORNKYEHHO-UHFFFAOYSA-N |
Molecular Formula | C5H8O |
MEM chloride, 94%
CAS: 3970-21-6 Molecular Formula: C4H9ClO2 Molecular Weight (g/mol): 124.56 MDL Number: MFCD00000888 InChI Key: BIAAQBNMRITRDV-UHFFFAOYSA-N Synonym: 2-methoxyethoxymethyl chloride,1-chloromethoxy-2-methoxyethane,ethane, 1-chloromethoxy-2-methoxy,mem chloride,methoxyethoxymethyl chloride,mem-chloride,1-chloro-2,5-dioxahexane,2-methoxyethoxy methyl chloride,beta-methoxyethoxymethyl chloride,.beta.-methoxyethoxymethyl chloride PubChem CID: 77590 IUPAC Name: 1-(chloromethoxy)-2-methoxyethane SMILES: COCCOCCl

PubChem CID | 77590 |
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CAS | 3970-21-6 |
Molecular Weight (g/mol) | 124.56 |
MDL Number | MFCD00000888 |
SMILES | COCCOCCl |
Synonym | 2-methoxyethoxymethyl chloride,1-chloromethoxy-2-methoxyethane,ethane, 1-chloromethoxy-2-methoxy,mem chloride,methoxyethoxymethyl chloride,mem-chloride,1-chloro-2,5-dioxahexane,2-methoxyethoxy methyl chloride,beta-methoxyethoxymethyl chloride,.beta.-methoxyethoxymethyl chloride |
IUPAC Name | 1-(chloromethoxy)-2-methoxyethane |
InChI Key | BIAAQBNMRITRDV-UHFFFAOYSA-N |
Molecular Formula | C4H9ClO2 |
4-Hydroxy-3-methoxymandelic acid, 99%
CAS: 55-10-7,2394-20-9 Molecular Formula: C9H9O5 Molecular Weight (g/mol): 197.17 MDL Number: MFCD00004235 InChI Key: CGQCWMIAEPEHNQ-QMMMGPOBSA-M Synonym: vanillylmandelic acid,vanilmandelic acid,dl-4-hydroxy-3-methoxymandelic acid,2-hydroxy-2-4-hydroxy-3-methoxyphenyl acetic acid,4-hydroxy-3-methoxymandelic acid,vanillomandelic acid,+/--vanillylmandelic acid,vma,alpha,4-dihydroxy-3-methoxybenzeneacetic acid,benzeneacetic acid, .alpha.,4-dihydroxy-3-methoxy PubChem CID: 1245 ChEBI: CHEBI:20106 SMILES: COC1=CC(=CC=C1O)[C@H](O)C([O-])=O

PubChem CID | 1245 |
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CAS | 55-10-7,2394-20-9 |
Molecular Weight (g/mol) | 197.17 |
ChEBI | CHEBI:20106 |
MDL Number | MFCD00004235 |
SMILES | COC1=CC(=CC=C1O)[C@H](O)C([O-])=O |
Synonym | vanillylmandelic acid,vanilmandelic acid,dl-4-hydroxy-3-methoxymandelic acid,2-hydroxy-2-4-hydroxy-3-methoxyphenyl acetic acid,4-hydroxy-3-methoxymandelic acid,vanillomandelic acid,+/--vanillylmandelic acid,vma,alpha,4-dihydroxy-3-methoxybenzeneacetic acid,benzeneacetic acid, .alpha.,4-dihydroxy-3-methoxy |
InChI Key | CGQCWMIAEPEHNQ-QMMMGPOBSA-M |
Molecular Formula | C9H9O5 |
3',4'-Dimethoxyacetophenone, 98%
CAS: 1131-62-0 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.2 MDL Number: MFCD00008737 InChI Key: IQZLUWLMQNGTIW-UHFFFAOYSA-N Synonym: 3',4'-dimethoxyacetophenone,1-3,4-dimethoxyphenyl ethanone,3,4-dimethoxyacetophenone,acetoveratrone,ethanone, 1-3,4-dimethoxyphenyl,1-3,4-dimethoxyphenyl ethan-1-one,3,4-dimethoxyphenyl methyl ketone,unii-5rv6436s8a,acetophenone, 3',4'-dimethoxy,acetophenone,4'-dimethoxy PubChem CID: 14328 ChEBI: CHEBI:86576 IUPAC Name: 1-(3,4-dimethoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)OC)OC

PubChem CID | 14328 |
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CAS | 1131-62-0 |
Molecular Weight (g/mol) | 180.2 |
ChEBI | CHEBI:86576 |
MDL Number | MFCD00008737 |
SMILES | CC(=O)C1=CC(=C(C=C1)OC)OC |
Synonym | 3',4'-dimethoxyacetophenone,1-3,4-dimethoxyphenyl ethanone,3,4-dimethoxyacetophenone,acetoveratrone,ethanone, 1-3,4-dimethoxyphenyl,1-3,4-dimethoxyphenyl ethan-1-one,3,4-dimethoxyphenyl methyl ketone,unii-5rv6436s8a,acetophenone, 3',4'-dimethoxy,acetophenone,4'-dimethoxy |
IUPAC Name | 1-(3,4-dimethoxyphenyl)ethanone |
InChI Key | IQZLUWLMQNGTIW-UHFFFAOYSA-N |
Molecular Formula | C10H12O3 |
1-Naphthaldehyde, 95%
CAS: 66-77-3 Molecular Formula: C11H8O Molecular Weight (g/mol): 156.18 MDL Number: MFCD00004003 InChI Key: SQAINHDHICKHLX-UHFFFAOYSA-N Synonym: 1-naphthaldehyde,1-formylnaphthalene,1-naphthalenecarboxaldehyde,1-naphthylaldehyde,alpha-naphthal,alpha-naphthaldehyde,naphthaldehyde,.alpha.-naphthal,alpha-naphthylcarboxaldehyde,alpha-naphthylaldehyde PubChem CID: 6195 ChEBI: CHEBI:52367 IUPAC Name: naphthalene-1-carbaldehyde SMILES: O=CC1=C2C=CC=CC2=CC=C1

PubChem CID | 6195 |
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CAS | 66-77-3 |
Molecular Weight (g/mol) | 156.18 |
ChEBI | CHEBI:52367 |
MDL Number | MFCD00004003 |
SMILES | O=CC1=C2C=CC=CC2=CC=C1 |
Synonym | 1-naphthaldehyde,1-formylnaphthalene,1-naphthalenecarboxaldehyde,1-naphthylaldehyde,alpha-naphthal,alpha-naphthaldehyde,naphthaldehyde,.alpha.-naphthal,alpha-naphthylcarboxaldehyde,alpha-naphthylaldehyde |
IUPAC Name | naphthalene-1-carbaldehyde |
InChI Key | SQAINHDHICKHLX-UHFFFAOYSA-N |
Molecular Formula | C11H8O |
2',5'-Dihydroxyacetophenone, 97%
CAS: 490-78-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002343 InChI Key: WLDWSGZHNBANIO-UHFFFAOYSA-N Synonym: 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy PubChem CID: 10279 IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)O)O

PubChem CID | 10279 |
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CAS | 490-78-8 |
Molecular Weight (g/mol) | 152.15 |
MDL Number | MFCD00002343 |
SMILES | CC(=O)C1=C(C=CC(=C1)O)O |
Synonym | 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy |
IUPAC Name | 1-(2,5-dihydroxyphenyl)ethanone |
InChI Key | WLDWSGZHNBANIO-UHFFFAOYSA-N |
Molecular Formula | C8H8O3 |
Ethyl 4,4,4-trifluoroacetoacetate, 97%
CAS: 372-31-6 Molecular Formula: C6H7F3O3 Molecular Weight (g/mol): 184.11 MDL Number: MFCD00000424 InChI Key: OCJKUQIPRNZDTK-UHFFFAOYSA-N Synonym: ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester PubChem CID: 67793 IUPAC Name: ethyl 4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)C(F)(F)F

PubChem CID | 67793 |
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CAS | 372-31-6 |
Molecular Weight (g/mol) | 184.11 |
MDL Number | MFCD00000424 |
SMILES | CCOC(=O)CC(=O)C(F)(F)F |
Synonym | ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester |
IUPAC Name | ethyl 4,4,4-trifluoro-3-oxobutanoate |
InChI Key | OCJKUQIPRNZDTK-UHFFFAOYSA-N |
Molecular Formula | C6H7F3O3 |
Diethyl methylmalonate, 99%
CAS: 609-08-5 Molecular Formula: C8H14O4 Molecular Weight (g/mol): 174.2 MDL Number: MFCD00009162 InChI Key: UPQZOUHVTJNGFK-UHFFFAOYSA-N Synonym: diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl PubChem CID: 11857 IUPAC Name: diethyl 2-methylpropanedioate SMILES: CCOC(=O)C(C)C(=O)OCC

PubChem CID | 11857 |
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CAS | 609-08-5 |
Molecular Weight (g/mol) | 174.2 |
MDL Number | MFCD00009162 |
SMILES | CCOC(=O)C(C)C(=O)OCC |
Synonym | diethyl methylmalonate,methylmalonic acid diethyl ester,diethyl 2-methylmalonate,propanedioic acid, methyl-, diethyl ester,1,3-diethyl 2-methylpropanedioate,diethylmethylmalonate,ethyl methylmalonate,diethyl methylpropanedioate,malonic acid, methyl-, diethyl ester,2-methylmalonic acid diethyl |
IUPAC Name | diethyl 2-methylpropanedioate |
InChI Key | UPQZOUHVTJNGFK-UHFFFAOYSA-N |
Molecular Formula | C8H14O4 |
3,5-Dimethoxybenzaldehyde, 98%
CAS: 7311-34-4 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00003366 InChI Key: VFZRZRDOXPRTSC-UHFFFAOYSA-N Synonym: 3,5-dimethoxy-benzaldehyde,benzaldehyde, 3,5-dimethoxy,3,5-dimethoxybenzaldehyd,pubchem2645,3,5 dimethoxybenzaldehyde,acmc-1bhx6,3,5 dimethoxylbenzaldehyde,3,5 dimethoxy benzaldehyde,3,5-dimethoxy benzaldehyde,ghl.pd_mitscher_leg0.694 PubChem CID: 81747 IUPAC Name: 3,5-dimethoxybenzaldehyde SMILES: COC1=CC(C=O)=CC(OC)=C1

PubChem CID | 81747 |
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CAS | 7311-34-4 |
Molecular Weight (g/mol) | 166.18 |
MDL Number | MFCD00003366 |
SMILES | COC1=CC(C=O)=CC(OC)=C1 |
Synonym | 3,5-dimethoxy-benzaldehyde,benzaldehyde, 3,5-dimethoxy,3,5-dimethoxybenzaldehyd,pubchem2645,3,5 dimethoxybenzaldehyde,acmc-1bhx6,3,5 dimethoxylbenzaldehyde,3,5 dimethoxy benzaldehyde,3,5-dimethoxy benzaldehyde,ghl.pd_mitscher_leg0.694 |
IUPAC Name | 3,5-dimethoxybenzaldehyde |
InChI Key | VFZRZRDOXPRTSC-UHFFFAOYSA-N |
Molecular Formula | C9H10O3 |
2-Methyl-1-propanol, 99+%, Extra Pure
CAS: 78-83-1 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.12 MDL Number: MFCD00004740 InChI Key: ZXEKIIBDNHEJCQ-UHFFFAOYSA-N Synonym: 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol PubChem CID: 6560 ChEBI: CHEBI:46645 IUPAC Name: 2-methylpropan-1-ol SMILES: CC(C)CO

PubChem CID | 6560 |
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CAS | 78-83-1 |
Molecular Weight (g/mol) | 74.12 |
ChEBI | CHEBI:46645 |
MDL Number | MFCD00004740 |
SMILES | CC(C)CO |
Synonym | 2-methyl-1-propanol,isobutanol,isobutyl alcohol,1-propanol, 2-methyl,1-hydroxymethylpropane,isopropylcarbinol,iso-butyl alcohol,2-methylpropyl alcohol,isobutylalkohol,i-butyl alcohol |
IUPAC Name | 2-methylpropan-1-ol |
InChI Key | ZXEKIIBDNHEJCQ-UHFFFAOYSA-N |
Molecular Formula | C4H10O |
2-Bromo-4'-cyanoacetophenone, 97%
CAS: 20099-89-2 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.06 MDL Number: MFCD00052931 InChI Key: LJANCPRIUMHGJE-UHFFFAOYSA-N Synonym: 4-2-bromoacetyl benzonitrile,4-cyanophenacyl bromide,4-bromoacetyl benzonitrile,2-bromo-4'-cyanoacetophenone,benzonitrile, 4-bromoacetyl,p-cyanophenacyl bromide,4-2-bromo-acetyl-benzonitrile,4-2-bromoethanoyl benzonitrile,4-2-bromoacetyl benzenecarbonitrile PubChem CID: 98654 IUPAC Name: 4-(2-bromoacetyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)C(=O)CBr

PubChem CID | 98654 |
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CAS | 20099-89-2 |
Molecular Weight (g/mol) | 224.06 |
MDL Number | MFCD00052931 |
SMILES | C1=CC(=CC=C1C#N)C(=O)CBr |
Synonym | 4-2-bromoacetyl benzonitrile,4-cyanophenacyl bromide,4-bromoacetyl benzonitrile,2-bromo-4'-cyanoacetophenone,benzonitrile, 4-bromoacetyl,p-cyanophenacyl bromide,4-2-bromo-acetyl-benzonitrile,4-2-bromoethanoyl benzonitrile,4-2-bromoacetyl benzenecarbonitrile |
IUPAC Name | 4-(2-bromoacetyl)benzonitrile |
InChI Key | LJANCPRIUMHGJE-UHFFFAOYSA-N |
Molecular Formula | C9H6BrNO |