Organooxygen compounds
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4,6-Diacetylresorcinol 98.0+%, TCI America™
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CAS: 2161-85-5 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00017655 InChI Key: GEYCQLIOGQPPFM-UHFFFAOYSA-N Synonym: 4,6-diacetylresorcinol,resodiacetophenone,1,1'-4,6-dihydroxy-1,3-phenylene bisethanone,ethanone, 1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethanone,1,1'-4,6-dihydroxy-1,3-phenylene diethanone,1,3-diacetyl-4,6-dihydroxybenzene,ethanone,1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethan-1-one,1,1'-4,6-dihydroxy-1,3-phenylene-bis-ethanone PubChem CID: 75097 IUPAC Name: 1-(5-acetyl-2,4-dihydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC(C(C)=O)=C(O)C=C1O
| PubChem CID | 75097 |
|---|---|
| CAS | 2161-85-5 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD00017655 |
| SMILES | CC(=O)C1=CC(C(C)=O)=C(O)C=C1O |
| Synonym | 4,6-diacetylresorcinol,resodiacetophenone,1,1'-4,6-dihydroxy-1,3-phenylene bisethanone,ethanone, 1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethanone,1,1'-4,6-dihydroxy-1,3-phenylene diethanone,1,3-diacetyl-4,6-dihydroxybenzene,ethanone,1,1'-4,6-dihydroxy-1,3-phenylene bis,1-5-acetyl-2,4-dihydroxyphenyl ethan-1-one,1,1'-4,6-dihydroxy-1,3-phenylene-bis-ethanone |
| IUPAC Name | 1-(5-acetyl-2,4-dihydroxyphenyl)ethan-1-one |
| InChI Key | GEYCQLIOGQPPFM-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
1-(2-Hydroxyethyl)pyrrole 99.0+%, TCI America™
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CAS: 6719-02-4 Molecular Formula: C6H9NO Molecular Weight (g/mol): 111.14 MDL Number: MFCD00191451 InChI Key: ZIOLCZCJJJNOEJ-UHFFFAOYSA-N PubChem CID: 10975438 IUPAC Name: 2-pyrrol-1-ylethanol SMILES: C1=CN(C=C1)CCO
| PubChem CID | 10975438 |
|---|---|
| CAS | 6719-02-4 |
| Molecular Weight (g/mol) | 111.14 |
| MDL Number | MFCD00191451 |
| SMILES | C1=CN(C=C1)CCO |
| IUPAC Name | 2-pyrrol-1-ylethanol |
| InChI Key | ZIOLCZCJJJNOEJ-UHFFFAOYSA-N |
| Molecular Formula | C6H9NO |
2-Amino-4,6-dimethoxypyrimidine 98.0+%, TCI America™
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CAS: 36315-01-2 Molecular Formula: C6H9N3O2 Molecular Weight (g/mol): 155.157 MDL Number: MFCD00038832 InChI Key: LVFRCHIUUKWBLR-UHFFFAOYSA-N Synonym: 2-amino-4,6-dimethoxypyrimidine,2-pyrimidinamine, 4,6-dimethoxy,4,6-dimethoxy-2-pyrimidinamine,4,6-dimethoxy-2-aminopyrimidine,4,6-dimethoxy-pyrimidin-2-ylamine,2-amino-4,6-dimethoxy pyrimidine,2-amino-4,6-dimethoxy-pyrimidine,4,6-dimethoxypyrimidine-2-ylamine,maybridge1_002259,zlchem 350 PubChem CID: 118946 IUPAC Name: 4,6-dimethoxypyrimidin-2-amine SMILES: COC1=CC(=NC(=N1)N)OC
| PubChem CID | 118946 |
|---|---|
| CAS | 36315-01-2 |
| Molecular Weight (g/mol) | 155.157 |
| MDL Number | MFCD00038832 |
| SMILES | COC1=CC(=NC(=N1)N)OC |
| Synonym | 2-amino-4,6-dimethoxypyrimidine,2-pyrimidinamine, 4,6-dimethoxy,4,6-dimethoxy-2-pyrimidinamine,4,6-dimethoxy-2-aminopyrimidine,4,6-dimethoxy-pyrimidin-2-ylamine,2-amino-4,6-dimethoxy pyrimidine,2-amino-4,6-dimethoxy-pyrimidine,4,6-dimethoxypyrimidine-2-ylamine,maybridge1_002259,zlchem 350 |
| IUPAC Name | 4,6-dimethoxypyrimidin-2-amine |
| InChI Key | LVFRCHIUUKWBLR-UHFFFAOYSA-N |
| Molecular Formula | C6H9N3O2 |
3'-Bromo-4'-hydroxyacetophenone 98.0+%, TCI America™
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CAS: 1836-06-2 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD05663950 InChI Key: LEXAYGVHWYOOAB-UHFFFAOYSA-N PubChem CID: 608094 IUPAC Name: 1-(3-bromo-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)O)Br
| PubChem CID | 608094 |
|---|---|
| CAS | 1836-06-2 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD05663950 |
| SMILES | CC(=O)C1=CC(=C(C=C1)O)Br |
| IUPAC Name | 1-(3-bromo-4-hydroxyphenyl)ethanone |
| InChI Key | LEXAYGVHWYOOAB-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
3'-Fluoroacetophenone 97.0+%, TCI America™
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CAS: 455-36-7 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.14 MDL Number: MFCD00000338 InChI Key: HCEKGPAHZCYRBZ-UHFFFAOYSA-N Synonym: 3'-fluoroacetophenone,1-3-fluorophenyl ethanone,3-fluoroacetophenone,m-fluoroacetophenone,ethanone, 1-3-fluorophenyl,1-3-fluorophenyl ethan-1-one,acetophenone, 3'-fluoro,3'-fluoro-acetophenone,1-acetyl-3-fluorobenzene PubChem CID: 9967 IUPAC Name: 1-(3-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=CC(F)=C1
| PubChem CID | 9967 |
|---|---|
| CAS | 455-36-7 |
| Molecular Weight (g/mol) | 138.14 |
| MDL Number | MFCD00000338 |
| SMILES | CC(=O)C1=CC=CC(F)=C1 |
| Synonym | 3'-fluoroacetophenone,1-3-fluorophenyl ethanone,3-fluoroacetophenone,m-fluoroacetophenone,ethanone, 1-3-fluorophenyl,1-3-fluorophenyl ethan-1-one,acetophenone, 3'-fluoro,3'-fluoro-acetophenone,1-acetyl-3-fluorobenzene |
| IUPAC Name | 1-(3-fluorophenyl)ethan-1-one |
| InChI Key | HCEKGPAHZCYRBZ-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO |
4-Sulfocalix[4]arene Hydrate 94.0+%, TCI America™
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CAS: 112269-92-8 Molecular Formula: C28H24O16S4 Molecular Weight (g/mol): 744.724 MDL Number: MFCD03095486 InChI Key: JFYBCAFLVNKHHG-UHFFFAOYSA-N Synonym: Tetrahydroxycalix[4]arenetetrasulfonic Acid, Tetrasulfo(tetrahydroxy)calix[4]arene PubChem CID: 644084 SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=C(C(=CC(=C4)S(=O)(=O)O)CC5=C(C1=CC(=C5)S(=O)(=O)O)O)O)S(=O)(=O)O)S(=O)(=O)O
| PubChem CID | 644084 |
|---|---|
| CAS | 112269-92-8 |
| Molecular Weight (g/mol) | 744.724 |
| MDL Number | MFCD03095486 |
| SMILES | C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=C(C(=CC(=C4)S(=O)(=O)O)CC5=C(C1=CC(=C5)S(=O)(=O)O)O)O)S(=O)(=O)O)S(=O)(=O)O |
| Synonym | Tetrahydroxycalix[4]arenetetrasulfonic Acid, Tetrasulfo(tetrahydroxy)calix[4]arene |
| InChI Key | JFYBCAFLVNKHHG-UHFFFAOYSA-N |
| Molecular Formula | C28H24O16S4 |
1-Bromoanthraquinone 95.0+%, TCI America™
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CAS: 632-83-7 Molecular Formula: C14H7BrO2 Molecular Weight (g/mol): 287.112 InChI Key: CXTPIHZYOGDSLV-UHFFFAOYSA-N PubChem CID: 12444 IUPAC Name: 1-bromoanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br
| PubChem CID | 12444 |
|---|---|
| CAS | 632-83-7 |
| Molecular Weight (g/mol) | 287.112 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Br |
| IUPAC Name | 1-bromoanthracene-9,10-dione |
| InChI Key | CXTPIHZYOGDSLV-UHFFFAOYSA-N |
| Molecular Formula | C14H7BrO2 |
1-Adamantaneethanol 98.0+%, TCI America™
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CAS: 6240-11-5 Molecular Formula: C12H20O Molecular Weight (g/mol): 180.29 MDL Number: MFCD00074756 InChI Key: ZBIDZPHRNBZTLT-UHFFFAOYSA-N Synonym: 1-adamantaneethanol,2-adamantan-1-yl ethanol,2-1-adamantyl ethanol,1-admantaneethanol,1-adamantane ethanol,tricyclo 3.3.1.13,7 decaneethanol 9ci,tricyclo 3.3.1.1 3,7-decane-1-ethanol,2-tricyclo 3.3.1.1'3,7 dec-1-yl ethanol,2-3r,5s,7s-adamantan-1-yl ethanol,2-adamantan-1-ylethanol PubChem CID: 110810 IUPAC Name: 2-(1-adamantyl)ethanol SMILES: C1C2CC3CC1CC(C2)(C3)CCO
| PubChem CID | 110810 |
|---|---|
| CAS | 6240-11-5 |
| Molecular Weight (g/mol) | 180.29 |
| MDL Number | MFCD00074756 |
| SMILES | C1C2CC3CC1CC(C2)(C3)CCO |
| Synonym | 1-adamantaneethanol,2-adamantan-1-yl ethanol,2-1-adamantyl ethanol,1-admantaneethanol,1-adamantane ethanol,tricyclo 3.3.1.13,7 decaneethanol 9ci,tricyclo 3.3.1.1 3,7-decane-1-ethanol,2-tricyclo 3.3.1.1'3,7 dec-1-yl ethanol,2-3r,5s,7s-adamantan-1-yl ethanol,2-adamantan-1-ylethanol |
| IUPAC Name | 2-(1-adamantyl)ethanol |
| InChI Key | ZBIDZPHRNBZTLT-UHFFFAOYSA-N |
| Molecular Formula | C12H20O |
cis-2-Butene-1,4-diol 94.0+%, TCI America™
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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: (2Z)-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 | (2Z)-but-2-ene-1,4-diol |
| InChI Key | ORTVZLZNOYNASJ-UPHRSURJSA-N |
| Molecular Formula | C4H8O2 |
Cetilistat 98.0+%, TCI America™
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CAS: 282526-98-1 Molecular Formula: C25H39NO3 Molecular Weight (g/mol): 401.591 MDL Number: MFCD09839697 InChI Key: MVCQKIKWYUURMU-UHFFFAOYSA-N Synonym: 2-Hexadecyloxy-6-methyl-4H-3,1-benzoxazin-4-one PubChem CID: 9952916 IUPAC Name: 2-hexadecoxy-6-methyl-3,1-benzoxazin-4-one SMILES: CCCCCCCCCCCCCCCCOC1=NC2=C(C=C(C=C2)C)C(=O)O1
| PubChem CID | 9952916 |
|---|---|
| CAS | 282526-98-1 |
| Molecular Weight (g/mol) | 401.591 |
| MDL Number | MFCD09839697 |
| SMILES | CCCCCCCCCCCCCCCCOC1=NC2=C(C=C(C=C2)C)C(=O)O1 |
| Synonym | 2-Hexadecyloxy-6-methyl-4H-3,1-benzoxazin-4-one |
| IUPAC Name | 2-hexadecoxy-6-methyl-3,1-benzoxazin-4-one |
| InChI Key | MVCQKIKWYUURMU-UHFFFAOYSA-N |
| Molecular Formula | C25H39NO3 |
4-Acetylphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 3702122 |
|---|---|
| CAS | 149104-90-5 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (4-acetylphenyl)boronic acid |
| InChI Key | OBQRODBYVNIZJU-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO3 |
| Formula Weight | 163.97 |
| Melting Point | 239°C |
6-Methyl-4-chromanone 98.0+%, TCI America™
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CAS: 39513-75-2 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00024071 InChI Key: RJHXEPLSJAVTFW-UHFFFAOYSA-N PubChem CID: 584354 IUPAC Name: 6-methyl-3,4-dihydro-2H-1-benzopyran-4-one SMILES: CC1=CC2=C(OCCC2=O)C=C1
| PubChem CID | 584354 |
|---|---|
| CAS | 39513-75-2 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00024071 |
| SMILES | CC1=CC2=C(OCCC2=O)C=C1 |
| IUPAC Name | 6-methyl-3,4-dihydro-2H-1-benzopyran-4-one |
| InChI Key | RJHXEPLSJAVTFW-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
5-Methyl-2,3-hexanedione 94.0+%, TCI America™
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CAS: 13706-86-0 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00059352 InChI Key: PQCLJXVUAWLNSV-UHFFFAOYSA-N Synonym: Acetylisovaleryl PubChem CID: 26204 IUPAC Name: 5-methylhexane-2,3-dione SMILES: CC(C)CC(=O)C(C)=O
| PubChem CID | 26204 |
|---|---|
| CAS | 13706-86-0 |
| Molecular Weight (g/mol) | 128.17 |
| MDL Number | MFCD00059352 |
| SMILES | CC(C)CC(=O)C(C)=O |
| Synonym | Acetylisovaleryl |
| IUPAC Name | 5-methylhexane-2,3-dione |
| InChI Key | PQCLJXVUAWLNSV-UHFFFAOYSA-N |
| Molecular Formula | C7H12O2 |
3,3,3-Trifluoro-1-propanol 98.0+%, TCI America™
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CAS: 2240-88-2 Molecular Formula: C3H5F3O Molecular Weight (g/mol): 114.067 MDL Number: MFCD00190649 InChI Key: HDBGBTNNPRCVND-UHFFFAOYSA-N Synonym: 3,3,3-trifluoro-1-propanol,3,3,3-trifluoropropanol,1-propanol, 3,3,3-trifluoro,trifluoropropanol,acmc-1cqb1,3,3,3-trifluoropropanol-1,2-trifluoromethyl ethan-1-ol,3,3,3-trifluoro-propan-1-ol,poly difluoromethylene , alpha-fluoro-omega-2-hydroxyethyl,3-hydroxy-1,1,1-trifluoropropane PubChem CID: 137512 IUPAC Name: 3,3,3-trifluoropropan-1-ol SMILES: C(CO)C(F)(F)F
| PubChem CID | 137512 |
|---|---|
| CAS | 2240-88-2 |
| Molecular Weight (g/mol) | 114.067 |
| MDL Number | MFCD00190649 |
| SMILES | C(CO)C(F)(F)F |
| Synonym | 3,3,3-trifluoro-1-propanol,3,3,3-trifluoropropanol,1-propanol, 3,3,3-trifluoro,trifluoropropanol,acmc-1cqb1,3,3,3-trifluoropropanol-1,2-trifluoromethyl ethan-1-ol,3,3,3-trifluoro-propan-1-ol,poly difluoromethylene , alpha-fluoro-omega-2-hydroxyethyl,3-hydroxy-1,1,1-trifluoropropane |
| IUPAC Name | 3,3,3-trifluoropropan-1-ol |
| InChI Key | HDBGBTNNPRCVND-UHFFFAOYSA-N |
| Molecular Formula | C3H5F3O |
1-(Methoxymethoxy)naphthalene 97.0+%, TCI America™
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CAS: 7382-37-8 Molecular Formula: C12H12O2 Molecular Weight (g/mol): 188.226 MDL Number: MFCD06797119 InChI Key: REELDIWIMZYNLC-UHFFFAOYSA-N PubChem CID: 10779684 IUPAC Name: 1-(methoxymethoxy)naphthalene SMILES: COCOC1=CC=CC2=CC=CC=C21
| PubChem CID | 10779684 |
|---|---|
| CAS | 7382-37-8 |
| Molecular Weight (g/mol) | 188.226 |
| MDL Number | MFCD06797119 |
| SMILES | COCOC1=CC=CC2=CC=CC=C21 |
| IUPAC Name | 1-(methoxymethoxy)naphthalene |
| InChI Key | REELDIWIMZYNLC-UHFFFAOYSA-N |
| Molecular Formula | C12H12O2 |