Organooxygen compounds
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tert-Butyl glycolate, 94%, Thermo Scientific Chemicals
CAS: 50595-15-8 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD03452739 InChI Key: WINGEFIITRDOLJ-UHFFFAOYSA-N Synonym: tert-butyl glycolate,2-tert-butyl glycolate,2-t-butyl glycolate,glycolic acid tert-butyl ester,hydroxyacetic acid tert-butyl ester,acetic acid, hydroxy-, 1,1-dimethylethyl ester,tert-butyl hydroxyacetate,t-butyl 2-hydroxyacetate,tert-butyl2-hydroxyacetate PubChem CID: 11815394 IUPAC Name: tert-butyl 2-hydroxyacetate SMILES: CC(C)(C)OC(=O)CO
| PubChem CID | 11815394 |
|---|---|
| CAS | 50595-15-8 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD03452739 |
| SMILES | CC(C)(C)OC(=O)CO |
| Synonym | tert-butyl glycolate,2-tert-butyl glycolate,2-t-butyl glycolate,glycolic acid tert-butyl ester,hydroxyacetic acid tert-butyl ester,acetic acid, hydroxy-, 1,1-dimethylethyl ester,tert-butyl hydroxyacetate,t-butyl 2-hydroxyacetate,tert-butyl2-hydroxyacetate |
| IUPAC Name | tert-butyl 2-hydroxyacetate |
| InChI Key | WINGEFIITRDOLJ-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
cis-2-Butene-1,4-diol, 97%
CAS: 6117-80-2 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00002924,MFCD00063207 InChI Key: ORTVZLZNOYNASJ-UPHRSURJSA-N Synonym: cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv PubChem CID: 643790 SMILES: OC\C=C/CO
| PubChem CID | 643790 |
|---|---|
| CAS | 6117-80-2 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00002924,MFCD00063207 |
| SMILES | OC\C=C/CO |
| Synonym | cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv |
| InChI Key | ORTVZLZNOYNASJ-UPHRSURJSA-N |
| Molecular Formula | C4H8O2 |
2-Cyclopentyloxypyridine-3-boronic acid pinacol ester, 96%, Thermo Scientific™
CAS: 1073371-90-0 Molecular Formula: C16H24BNO3 Molecular Weight (g/mol): 289.18 MDL Number: MFCD07781170 InChI Key: GZCZGFSEHAZEPS-UHFFFAOYSA-N Synonym: 2-cyclopentyloxy-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxypyridine-3-boronic acid pinacol ester,2-cyclopentyloxy pyridine-3-boronic acid pinacol ester,2-cyclopentyloxy-3-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxy pyridine-3-boronic acid, pinacol ester,2-cyclopentyloxy pyridin-3-yl boronic acid pinacol ester PubChem CID: 24208792 IUPAC Name: 2-cyclopentyloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine SMILES: CC1(C)OB(OC1(C)C)C1=C(OC2CCCC2)N=CC=C1
| PubChem CID | 24208792 |
|---|---|
| CAS | 1073371-90-0 |
| Molecular Weight (g/mol) | 289.18 |
| MDL Number | MFCD07781170 |
| SMILES | CC1(C)OB(OC1(C)C)C1=C(OC2CCCC2)N=CC=C1 |
| Synonym | 2-cyclopentyloxy-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxypyridine-3-boronic acid pinacol ester,2-cyclopentyloxy pyridine-3-boronic acid pinacol ester,2-cyclopentyloxy-3-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine,2-cyclopentyloxy pyridine-3-boronic acid, pinacol ester,2-cyclopentyloxy pyridin-3-yl boronic acid pinacol ester |
| IUPAC Name | 2-cyclopentyloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
| InChI Key | GZCZGFSEHAZEPS-UHFFFAOYSA-N |
| Molecular Formula | C16H24BNO3 |
6-Morpholin-4-yl-pyridine-3-carbaldehyde, 97%, Thermo Scientific™
CAS: 173282-60-5 Molecular Formula: C10H12N2O2 Molecular Weight (g/mol): 192.22 MDL Number: MFCD03659703 InChI Key: VZEANTSDLFVWCK-UHFFFAOYSA-N Synonym: 6-morpholinonicotinaldehyde,6-morpholin-4-yl-pyridine-3-carbaldehyde,6-morpholin-4-ylnicotinaldehyde,6-morpholin-4-yl pyridine-3-carbaldehyde,6-morpholin-4-yl pyridine-3-carboxaldehyde,6-morpholinylpyridine-3-carboxaldehyde,6-morpholin-4-yl nicotinaldehyde,6-morpholin-4-yl-pyridine-3-carbaldehyd,6-4-morpholinyl-3-pyridinecarboxaldehyde,3-pyridinecarboxaldehyde,6-4-morpholinyl PubChem CID: 2776463 SMILES: O=CC1=CN=C(C=C1)N1CCOCC1
| PubChem CID | 2776463 |
|---|---|
| CAS | 173282-60-5 |
| Molecular Weight (g/mol) | 192.22 |
| MDL Number | MFCD03659703 |
| SMILES | O=CC1=CN=C(C=C1)N1CCOCC1 |
| Synonym | 6-morpholinonicotinaldehyde,6-morpholin-4-yl-pyridine-3-carbaldehyde,6-morpholin-4-ylnicotinaldehyde,6-morpholin-4-yl pyridine-3-carbaldehyde,6-morpholin-4-yl pyridine-3-carboxaldehyde,6-morpholinylpyridine-3-carboxaldehyde,6-morpholin-4-yl nicotinaldehyde,6-morpholin-4-yl-pyridine-3-carbaldehyd,6-4-morpholinyl-3-pyridinecarboxaldehyde,3-pyridinecarboxaldehyde,6-4-morpholinyl |
| InChI Key | VZEANTSDLFVWCK-UHFFFAOYSA-N |
| Molecular Formula | C10H12N2O2 |
2',4'-Dimethylacetophenone, 95%
CAS: 89-74-7 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00003571 InChI Key: HSDSKVWQTONQBJ-UHFFFAOYSA-N Synonym: 2',4'-dimethylacetophenone,1-2,4-dimethylphenyl ethanone,2,4-dimethylacetophenone,4-acetyl-m-xylene,ethanone, 1-2,4-dimethylphenyl,acetyl-m-xylene,1-2,4-dimethylphenyl ethan-1-one,acetophenone, 2',4'-dimethyl,unii-8k29me27ya,methyl 2,4-dimethylphenyl ketone PubChem CID: 6985 IUPAC Name: 1-(2,4-dimethylphenyl)ethanone SMILES: CC1=CC(=C(C=C1)C(=O)C)C
| PubChem CID | 6985 |
|---|---|
| CAS | 89-74-7 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00003571 |
| SMILES | CC1=CC(=C(C=C1)C(=O)C)C |
| Synonym | 2',4'-dimethylacetophenone,1-2,4-dimethylphenyl ethanone,2,4-dimethylacetophenone,4-acetyl-m-xylene,ethanone, 1-2,4-dimethylphenyl,acetyl-m-xylene,1-2,4-dimethylphenyl ethan-1-one,acetophenone, 2',4'-dimethyl,unii-8k29me27ya,methyl 2,4-dimethylphenyl ketone |
| IUPAC Name | 1-(2,4-dimethylphenyl)ethanone |
| InChI Key | HSDSKVWQTONQBJ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
Cafestol from Coffee Beans, MP Biomedicals™
CAS: 469-83-0 Molecular Formula: C20H28O3 Molecular Weight (g/mol): 316.44 MDL Number: MFCD01075769 InChI Key: DNJVYWXIDISQRD-HWUKTEKMSA-N IUPAC Name: (1S,4S,12S,13R,16R,17R)-17-(hydroxymethyl)-12-methyl-8-oxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁵,⁹]nonadeca-5(9),6-dien-17-ol SMILES: C[C@@]12CCC3=C(C=CO3)[C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)[C@@](O)(CO)C3
| CAS | 469-83-0 |
|---|---|
| Molecular Weight (g/mol) | 316.44 |
| MDL Number | MFCD01075769 |
| SMILES | C[C@@]12CCC3=C(C=CO3)[C@H]1CC[C@@]13C[C@@H](CC[C@@H]21)[C@@](O)(CO)C3 |
| IUPAC Name | (1S,4S,12S,13R,16R,17R)-17-(hydroxymethyl)-12-methyl-8-oxapentacyclo[14.2.1.0¹,¹³.0⁴,¹².0⁵,⁹]nonadeca-5(9),6-dien-17-ol |
| InChI Key | DNJVYWXIDISQRD-HWUKTEKMSA-N |
| Molecular Formula | C20H28O3 |
cis-2-Butene-1,4-diol, 96%, remainder trans-isomer
CAS: 6117-80-2 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 88.11 MDL Number: MFCD00002924,MFCD00063207 InChI Key: ORTVZLZNOYNASJ-UPHRSURJSA-N Synonym: cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv PubChem CID: 643790 IUPAC Name: (Z)-but-2-ene-1,4-diol SMILES: OC\C=C/CO
| PubChem CID | 643790 |
|---|---|
| CAS | 6117-80-2 |
| Molecular Weight (g/mol) | 88.11 |
| MDL Number | MFCD00002924,MFCD00063207 |
| SMILES | OC\C=C/CO |
| Synonym | cis-2-butene-1,4-diol,z-2-butene-1,4-diol,cis-butenediol,unii-za7vgu6scv,cis-1,4-dihydroxy-2-butene,z-but-2-ene-1,4-diol,2-butene-1,4-diol,2z-but-2-ene-1,4-diol,2-butene-1,4-diol, z,za7vgu6scv |
| IUPAC Name | (Z)-but-2-ene-1,4-diol |
| InChI Key | ORTVZLZNOYNASJ-UPHRSURJSA-N |
| Molecular Formula | C4H8O2 |
2-Bromo-3'-methoxyacetophenone, 98%
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 |
3',5'-Di-tert-butyl-4'-hydroxyacetophenone, 98%
CAS: 14035-33-7 Molecular Formula: C16H24O2 Molecular Weight (g/mol): 248.37 MDL Number: MFCD00017520 InChI Key: WGJPGMJLARWHRK-UHFFFAOYSA-N Synonym: 1-3,5-di-tert-butyl-4-hydroxyphenyl ethanone,1-3,5-ditert-butyl-4-hydroxyphenyl ethanone,1-3,5-di tert-butyl-4-hydroxyphenyl ethan-1-one,3',5'-di-tert-butyl-4'-hydroxyacetophenone,3,5-di-tert-butyl-4-hydroxyacetophenone,1-3,5-di-tert-butyl-4-hydroxyphenyl ethan-1-one,ethanone, 1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl,1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl ethanone,1-acetyl-3,5-bis tert-butyl-4-hydroxybenzene,cbmicro_019190 PubChem CID: 616296 IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
| PubChem CID | 616296 |
|---|---|
| CAS | 14035-33-7 |
| Molecular Weight (g/mol) | 248.37 |
| MDL Number | MFCD00017520 |
| SMILES | CC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C |
| Synonym | 1-3,5-di-tert-butyl-4-hydroxyphenyl ethanone,1-3,5-ditert-butyl-4-hydroxyphenyl ethanone,1-3,5-di tert-butyl-4-hydroxyphenyl ethan-1-one,3',5'-di-tert-butyl-4'-hydroxyacetophenone,3,5-di-tert-butyl-4-hydroxyacetophenone,1-3,5-di-tert-butyl-4-hydroxyphenyl ethan-1-one,ethanone, 1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl,1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl ethanone,1-acetyl-3,5-bis tert-butyl-4-hydroxybenzene,cbmicro_019190 |
| IUPAC Name | 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone |
| InChI Key | WGJPGMJLARWHRK-UHFFFAOYSA-N |
| Molecular Formula | C16H24O2 |
Methyl 4-chloroacetoacetate, 97+%
CAS: 32807-28-6 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00000938 InChI Key: HFLMYYLFSNEOOT-UHFFFAOYSA-N Synonym: methyl 4-chloroacetoacetate,methyl 4-chloro-3-oxo-butanoate,butanoic acid, 4-chloro-3-oxo-, methyl ester,4-chloroacetoacetic acid methyl ester,methyl 4-chloro-3-oxobutyrate,methyl gamma-chloroacetoacetate,methyl-4-chloroacetoacetate,acetoacetic acid, 4-chloro-, methyl ester,4-chloroacetonacetic acid nethyl ester,pubchem11042 PubChem CID: 36240 IUPAC Name: methyl 4-chloro-3-oxobutanoate SMILES: COC(=O)CC(=O)CCl
| PubChem CID | 36240 |
|---|---|
| CAS | 32807-28-6 |
| Molecular Weight (g/mol) | 150.56 |
| MDL Number | MFCD00000938 |
| SMILES | COC(=O)CC(=O)CCl |
| Synonym | methyl 4-chloroacetoacetate,methyl 4-chloro-3-oxo-butanoate,butanoic acid, 4-chloro-3-oxo-, methyl ester,4-chloroacetoacetic acid methyl ester,methyl 4-chloro-3-oxobutyrate,methyl gamma-chloroacetoacetate,methyl-4-chloroacetoacetate,acetoacetic acid, 4-chloro-, methyl ester,4-chloroacetonacetic acid nethyl ester,pubchem11042 |
| IUPAC Name | methyl 4-chloro-3-oxobutanoate |
| InChI Key | HFLMYYLFSNEOOT-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO3 |
Ethyl 4-chloroacetoacetate, 97%
CAS: 638-07-3 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.585 MDL Number: MFCD00000939 InChI Key: OHLRLMWUFVDREV-UHFFFAOYSA-N Synonym: ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate PubChem CID: 69484 IUPAC Name: ethyl 4-chloro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)CCl
| PubChem CID | 69484 |
|---|---|
| CAS | 638-07-3 |
| Molecular Weight (g/mol) | 164.585 |
| MDL Number | MFCD00000939 |
| SMILES | CCOC(=O)CC(=O)CCl |
| Synonym | ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate |
| IUPAC Name | ethyl 4-chloro-3-oxobutanoate |
| InChI Key | OHLRLMWUFVDREV-UHFFFAOYSA-N |
| Molecular Formula | C6H9ClO3 |
L-Ascorbic Acid ACS AR, Macron Fine Chemicals™
CAS: 50-81-7 Molecular Formula: C6H8O6 Molecular Weight (g/mol): 176.12 MDL Number: MFCD00064328 InChI Key: CIWBSHSKHKDKBQ-DOMZIZNONA-N Synonym: l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin PubChem CID: 54670067 ChEBI: CHEBI:29073 SMILES: OC[C@H](O)[C@H]1OC(=O)C(O)=C1O
| PubChem CID | 54670067 |
|---|---|
| CAS | 50-81-7 |
| Molecular Weight (g/mol) | 176.12 |
| ChEBI | CHEBI:29073 |
| MDL Number | MFCD00064328 |
| SMILES | OC[C@H](O)[C@H]1OC(=O)C(O)=C1O |
| Synonym | l-ascorbic acid,ascorbic acid,vitamin c,l-ascorbate,ascorbate,ascorbicap,l +-ascorbic acid,cevitamic acid,ascoltin,hybrin |
| InChI Key | CIWBSHSKHKDKBQ-DOMZIZNONA-N |
| Molecular Formula | C6H8O6 |
2-Bromo-4'-nitroacetophenone, 95%
CAS: 99-81-0 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.04 MDL Number: MFCD00007356 InChI Key: MBUPVGIGAMCMBT-UHFFFAOYSA-N Synonym: 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone PubChem CID: 66840 IUPAC Name: 2-bromo-1-(4-nitrophenyl)ethanone SMILES: C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-]
| PubChem CID | 66840 |
|---|---|
| CAS | 99-81-0 |
| Molecular Weight (g/mol) | 244.04 |
| MDL Number | MFCD00007356 |
| SMILES | C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-] |
| Synonym | 2-bromo-4'-nitroacetophenone,2-bromo-1-4-nitrophenyl ethanone,4-nitrophenacyl bromide,p-nitrophenacyl bromide,2-bromo-1-4-nitrophenyl ethan-1-one,alpha-bromo-p-nitroacetophenone,ethanone, 2-bromo-1-4-nitrophenyl,4'-nitrophenacyl bromide,alpha-bromo-4-nitroacetophenone,2-bromo-4-nitroacetophenone |
| IUPAC Name | 2-bromo-1-(4-nitrophenyl)ethanone |
| InChI Key | MBUPVGIGAMCMBT-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
Acetylacetaldehyde dimethyl acetal, 92%
CAS: 5436-21-5 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.16 MDL Number: MFCD00008789 InChI Key: PJCCSZUMZMCWSX-UHFFFAOYSA-N Synonym: 4,4-dimethoxy-2-butanone,acetylacetaldehyde dimethyl acetal,2-butanone, 4,4-dimethoxy,1,1-dimethoxy-3-butanone,acetoacetaldehyde dimethyl acetal,3-oxobutyraldehyde dimethyl acetal,4,4-dimethoxybutanone,acetylacetaldehyddimethylacetal,3-ketobutyraldehyde dimethylacetal,formylacetone dimethyl acetal PubChem CID: 228548 IUPAC Name: 4,4-dimethoxybutan-2-one SMILES: COC(CC(C)=O)OC
| PubChem CID | 228548 |
|---|---|
| CAS | 5436-21-5 |
| Molecular Weight (g/mol) | 132.16 |
| MDL Number | MFCD00008789 |
| SMILES | COC(CC(C)=O)OC |
| Synonym | 4,4-dimethoxy-2-butanone,acetylacetaldehyde dimethyl acetal,2-butanone, 4,4-dimethoxy,1,1-dimethoxy-3-butanone,acetoacetaldehyde dimethyl acetal,3-oxobutyraldehyde dimethyl acetal,4,4-dimethoxybutanone,acetylacetaldehyddimethylacetal,3-ketobutyraldehyde dimethylacetal,formylacetone dimethyl acetal |
| IUPAC Name | 4,4-dimethoxybutan-2-one |
| InChI Key | PJCCSZUMZMCWSX-UHFFFAOYSA-N |
| Molecular Formula | C6H12O3 |
3-Bromo-1-propanol, 92%
CAS: 627-18-9 Molecular Formula: C3H7BrO Molecular Weight (g/mol): 138.99 MDL Number: MFCD00002942 InChI Key: RQFUZUMFPRMVDX-UHFFFAOYSA-N Synonym: 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh PubChem CID: 12308 IUPAC Name: 3-bromopropan-1-ol SMILES: OCCCBr
| PubChem CID | 12308 |
|---|---|
| CAS | 627-18-9 |
| Molecular Weight (g/mol) | 138.99 |
| MDL Number | MFCD00002942 |
| SMILES | OCCCBr |
| Synonym | 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh |
| IUPAC Name | 3-bromopropan-1-ol |
| InChI Key | RQFUZUMFPRMVDX-UHFFFAOYSA-N |
| Molecular Formula | C3H7BrO |