Organooxygen compounds
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2-(Bromoacetyl)-6-methoxynaphthalene, 96%, Thermo Scientific Chemicals
CAS: 10262-65-4 Molecular Formula: C13H11BrO2 Molecular Weight (g/mol): 279.13 InChI Key: HHHKEQGAGUAOQI-UHFFFAOYSA-N Synonym: 2-bromoacetyl-6-methoxynaphthalene,2-bromo-1-6-methoxy-2-naphthyl ethanone,2-bromo-6'-methoxy-2'-acetonaphthone,2-bromo-1-6-methoxynaphthalen-2-yl ethan-1-one,2-bromo-1-6-methoxynaphthalen-2-yl ethanone,ethanone, 2-bromo-1-6-methoxy-2-naphthalenyl,enamine_005243,2-bromo-1-6-methoxy-naphthalen-2-yl-ethanone PubChem CID: 193452 IUPAC Name: 2-bromo-1-(6-methoxynaphthalen-2-yl)ethanone SMILES: COC1=CC2=C(C=C1)C=C(C=C2)C(=O)CBr
| PubChem CID | 193452 |
|---|---|
| CAS | 10262-65-4 |
| Molecular Weight (g/mol) | 279.13 |
| SMILES | COC1=CC2=C(C=C1)C=C(C=C2)C(=O)CBr |
| Synonym | 2-bromoacetyl-6-methoxynaphthalene,2-bromo-1-6-methoxy-2-naphthyl ethanone,2-bromo-6'-methoxy-2'-acetonaphthone,2-bromo-1-6-methoxynaphthalen-2-yl ethan-1-one,2-bromo-1-6-methoxynaphthalen-2-yl ethanone,ethanone, 2-bromo-1-6-methoxy-2-naphthalenyl,enamine_005243,2-bromo-1-6-methoxy-naphthalen-2-yl-ethanone |
| IUPAC Name | 2-bromo-1-(6-methoxynaphthalen-2-yl)ethanone |
| InChI Key | HHHKEQGAGUAOQI-UHFFFAOYSA-N |
| Molecular Formula | C13H11BrO2 |
Isopropylmalonic acid, 98+%
CAS: 601-79-6 Molecular Formula: C6H10O4 Molecular Weight (g/mol): 146.14 MDL Number: MFCD00021717 InChI Key: DQEUFPARIOFOAI-UHFFFAOYSA-N Synonym: isopropylmalonic acid,2-isopropylmalonic acid,malonic acid, isopropyl,2-isopropylpropanedioic acid,propanedioic acid, 1-methylethyl,.alpha.-carboxyisovaleric acid,2-propan-2-yl propanedioic acid,isopropylmalonsaure,isopropyl malonic acid,iso-propyl malonic acid PubChem CID: 69037 IUPAC Name: 2-propan-2-ylpropanedioic acid SMILES: CC(C)C(C(O)=O)C(O)=O
| PubChem CID | 69037 |
|---|---|
| CAS | 601-79-6 |
| Molecular Weight (g/mol) | 146.14 |
| MDL Number | MFCD00021717 |
| SMILES | CC(C)C(C(O)=O)C(O)=O |
| Synonym | isopropylmalonic acid,2-isopropylmalonic acid,malonic acid, isopropyl,2-isopropylpropanedioic acid,propanedioic acid, 1-methylethyl,.alpha.-carboxyisovaleric acid,2-propan-2-yl propanedioic acid,isopropylmalonsaure,isopropyl malonic acid,iso-propyl malonic acid |
| IUPAC Name | 2-propan-2-ylpropanedioic acid |
| InChI Key | DQEUFPARIOFOAI-UHFFFAOYSA-N |
| Molecular Formula | C6H10O4 |
Cyclobutanol, 99+%
CAS: 2919-23-5 Molecular Formula: C4H8O Molecular Weight (g/mol): 72.11 MDL Number: MFCD00001318 InChI Key: KTHXBEHDVMTNOH-UHFFFAOYSA-N Synonym: cyclobutyl alcohol,cyclobutyl hydroxide,hydroxycyclobutane,acmc-1cgim,cyclobutanol,cyclobutanol 1g,ksc206s6t,kthxbehdvmtnoh-uhfffaoysa PubChem CID: 76218 IUPAC Name: cyclobutanol SMILES: OC1CCC1
| PubChem CID | 76218 |
|---|---|
| CAS | 2919-23-5 |
| Molecular Weight (g/mol) | 72.11 |
| MDL Number | MFCD00001318 |
| SMILES | OC1CCC1 |
| Synonym | cyclobutyl alcohol,cyclobutyl hydroxide,hydroxycyclobutane,acmc-1cgim,cyclobutanol,cyclobutanol 1g,ksc206s6t,kthxbehdvmtnoh-uhfffaoysa |
| IUPAC Name | cyclobutanol |
| InChI Key | KTHXBEHDVMTNOH-UHFFFAOYSA-N |
| Molecular Formula | C4H8O |
Thermo Scientific Chemicals 2-[Di(methylthio)methylidene]malononitrile, 97%, Thermo Scientific™
CAS: 5147-80-8 Molecular Formula: C6H6N2S2 Molecular Weight (g/mol): 170.248 MDL Number: MFCD00052730 InChI Key: FICQFRCPSFCFBY-UHFFFAOYSA-N Synonym: 2-bis methylthio methylene malononitrile,bis methylthio methylene malononitrile,2-di methylthio methylidene malononitrile,propanedinitrile, bis methylthio methylene,2-bis methylsulfanyl methylidene propanedinitrile,bis methylthio methylene propanedinitrile,3,3-bis methylthio-2-cyanoacrylonitrile,bis methylthio methylidene propanedinitrile PubChem CID: 99229 IUPAC Name: 2-[bis(methylsulfanyl)methylidene]propanedinitrile SMILES: CSC(=C(C#N)C#N)SC
| PubChem CID | 99229 |
|---|---|
| CAS | 5147-80-8 |
| Molecular Weight (g/mol) | 170.248 |
| MDL Number | MFCD00052730 |
| SMILES | CSC(=C(C#N)C#N)SC |
| Synonym | 2-bis methylthio methylene malononitrile,bis methylthio methylene malononitrile,2-di methylthio methylidene malononitrile,propanedinitrile, bis methylthio methylene,2-bis methylsulfanyl methylidene propanedinitrile,bis methylthio methylene propanedinitrile,3,3-bis methylthio-2-cyanoacrylonitrile,bis methylthio methylidene propanedinitrile |
| IUPAC Name | 2-[bis(methylsulfanyl)methylidene]propanedinitrile |
| InChI Key | FICQFRCPSFCFBY-UHFFFAOYSA-N |
| Molecular Formula | C6H6N2S2 |
2-Butynal diethyl acetal, 98%
CAS: 2806-97-5 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00009274 InChI Key: FKKVKKSEVMQYER-UHFFFAOYSA-N Synonym: 2-butynal diethyl acetal,2-butyn-1-al diethyl acetal,2-butynyl aldehyde diethyl acetal,2-butyne, 1,1-diethoxy,1,1-diethoxy-but-2-yne,1-diethoxybut-2-yne,acmc-20ao12,tetrolaldehyde diethyl acetal,1,1-diethoxy-2-butyne # PubChem CID: 137721 IUPAC Name: 1,1-diethoxybut-2-yne SMILES: CCOC(OCC)C#CC
| PubChem CID | 137721 |
|---|---|
| CAS | 2806-97-5 |
| Molecular Weight (g/mol) | 142.20 |
| MDL Number | MFCD00009274 |
| SMILES | CCOC(OCC)C#CC |
| Synonym | 2-butynal diethyl acetal,2-butyn-1-al diethyl acetal,2-butynyl aldehyde diethyl acetal,2-butyne, 1,1-diethoxy,1,1-diethoxy-but-2-yne,1-diethoxybut-2-yne,acmc-20ao12,tetrolaldehyde diethyl acetal,1,1-diethoxy-2-butyne # |
| IUPAC Name | 1,1-diethoxybut-2-yne |
| InChI Key | FKKVKKSEVMQYER-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
2,3-Hexanedione, 94%
CAS: 3848-24-6 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00009398 InChI Key: MWVFCEVNXHTDNF-UHFFFAOYSA-N Synonym: 2,3-hexanedione,acetylbutyryl,acetyl butyryl,methyl propyl diketone,butyryl acetyl,hexanedione,unii-559anr3nvs,2,3-hexandione,fema no. 2558,559anr3nvs PubChem CID: 19707 ChEBI: CHEBI:87583 IUPAC Name: hexane-2,3-dione SMILES: CCCC(=O)C(C)=O
| PubChem CID | 19707 |
|---|---|
| CAS | 3848-24-6 |
| Molecular Weight (g/mol) | 114.14 |
| ChEBI | CHEBI:87583 |
| MDL Number | MFCD00009398 |
| SMILES | CCCC(=O)C(C)=O |
| Synonym | 2,3-hexanedione,acetylbutyryl,acetyl butyryl,methyl propyl diketone,butyryl acetyl,hexanedione,unii-559anr3nvs,2,3-hexandione,fema no. 2558,559anr3nvs |
| IUPAC Name | hexane-2,3-dione |
| InChI Key | MWVFCEVNXHTDNF-UHFFFAOYSA-N |
| Molecular Formula | C6H10O2 |
Riboflavin, USP, 98-102%, Spectrum™ Chemical
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CAS: 83-88-5 Molecular Formula: C17H20N4O6 Molecular Weight (g/mol): 376.37 MDL Number: MFCD00005022 InChI Key: AUNGANRZJHBGPY-QTZZOOGMNA-N IUPAC Name: 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione SMILES: CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1
| CAS | 83-88-5 |
|---|---|
| Molecular Weight (g/mol) | 376.37 |
| MDL Number | MFCD00005022 |
| SMILES | CC1=C(C)C=C2N(C[C@H](O)[C@H](O)[C@H](O)CO)C3=NC(=O)NC(=O)C3=NC2=C1 |
| IUPAC Name | 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione |
| InChI Key | AUNGANRZJHBGPY-QTZZOOGMNA-N |
| Molecular Formula | C17H20N4O6 |
2-Methoxyethanol, ACS, 99.3+%
CAS: 109-86-4 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.095 MDL Number: MFCD00002867 InChI Key: XNWFRZJHXBZDAG-UHFFFAOYSA-N Synonym: methyl cellosolve,ethanol, 2-methoxy,ethylene glycol monomethyl ether,methyl oxitol,2-methoxy-1-ethanol,methoxyethanol,3-oxa-1-butanol,egme,monomethyl glycol,dowanol em PubChem CID: 8019 ChEBI: CHEBI:46790 IUPAC Name: 2-methoxyethanol SMILES: COCCO
| PubChem CID | 8019 |
|---|---|
| CAS | 109-86-4 |
| Molecular Weight (g/mol) | 76.095 |
| ChEBI | CHEBI:46790 |
| MDL Number | MFCD00002867 |
| SMILES | COCCO |
| Synonym | methyl cellosolve,ethanol, 2-methoxy,ethylene glycol monomethyl ether,methyl oxitol,2-methoxy-1-ethanol,methoxyethanol,3-oxa-1-butanol,egme,monomethyl glycol,dowanol em |
| IUPAC Name | 2-methoxyethanol |
| InChI Key | XNWFRZJHXBZDAG-UHFFFAOYSA-N |
| Molecular Formula | C3H8O2 |
2-Butyn-1-ol, 98%
CAS: 764-01-2 Molecular Formula: C4H6O Molecular Weight (g/mol): 70.091 MDL Number: MFCD00002914 InChI Key: NEEDEQSZOUAJMU-UHFFFAOYSA-N Synonym: 2-butyn-1-ol,2-butynol,2-butyne-1-ol,hydroxymethylmethylacetylene,2-butynyl alcohol,1-hydroxybut-2-yne,2-butyn-l-ol,2-butyn1-ol,2-butin-1-ol,but-2-in-1-ol PubChem CID: 12991 IUPAC Name: but-2-yn-1-ol SMILES: CC#CCO
| PubChem CID | 12991 |
|---|---|
| CAS | 764-01-2 |
| Molecular Weight (g/mol) | 70.091 |
| MDL Number | MFCD00002914 |
| SMILES | CC#CCO |
| Synonym | 2-butyn-1-ol,2-butynol,2-butyne-1-ol,hydroxymethylmethylacetylene,2-butynyl alcohol,1-hydroxybut-2-yne,2-butyn-l-ol,2-butyn1-ol,2-butin-1-ol,but-2-in-1-ol |
| IUPAC Name | but-2-yn-1-ol |
| InChI Key | NEEDEQSZOUAJMU-UHFFFAOYSA-N |
| Molecular Formula | C4H6O |
(1-methyl-5-phenyl-1H-pyrazol-4-yl)methanol, Thermo Scientific™
CAS: 499785-47-6 Molecular Formula: C11H12N2O Molecular Weight (g/mol): 188.23 MDL Number: MFCD04115390 InChI Key: ZVGZXURABHDVPS-UHFFFAOYSA-N Synonym: 1-methyl-5-phenyl-1h-pyrazol-4-yl methanol,1-methyl-5-phenylpyrazol-4-yl methanol,1-methyl-5-phenylpyrazol-4-yl methan-1-ol,bck PubChem CID: 2795476 SMILES: CN1N=CC(CO)=C1C1=CC=CC=C1
| PubChem CID | 2795476 |
|---|---|
| CAS | 499785-47-6 |
| Molecular Weight (g/mol) | 188.23 |
| MDL Number | MFCD04115390 |
| SMILES | CN1N=CC(CO)=C1C1=CC=CC=C1 |
| Synonym | 1-methyl-5-phenyl-1h-pyrazol-4-yl methanol,1-methyl-5-phenylpyrazol-4-yl methanol,1-methyl-5-phenylpyrazol-4-yl methan-1-ol,bck |
| InChI Key | ZVGZXURABHDVPS-UHFFFAOYSA-N |
| Molecular Formula | C11H12N2O |
| CAS | 2378-02-1 |
|---|---|
| MDL Number | MFCD00042092 |
4'-(Trifluoromethoxy)acetophenone, 98%, Thermo Scientific™
CAS: 85013-98-5 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.15 MDL Number: MFCD00042404 InChI Key: MOEXTBIPPMLEFX-UHFFFAOYSA-N Synonym: 4'-trifluoromethoxy acetophenone,1-4-trifluoromethoxy phenyl ethanone,4-trifluoromethoxy acetophenone,1-4-trifluoromethoxy phenyl ethan-1-one,4'-trifluoromethoxyacetophenone,1-4-trifluoromethoxy-phenyl-ethanone,ethanone, 1-4-trifluoromethoxy phenyl,4-trifluoromethoxyacetophenone PubChem CID: 522821 IUPAC Name: 1-[4-(trifluoromethoxy)phenyl]ethanone SMILES: CC(=O)C1=CC=C(OC(F)(F)F)C=C1
| PubChem CID | 522821 |
|---|---|
| CAS | 85013-98-5 |
| Molecular Weight (g/mol) | 204.15 |
| MDL Number | MFCD00042404 |
| SMILES | CC(=O)C1=CC=C(OC(F)(F)F)C=C1 |
| Synonym | 4'-trifluoromethoxy acetophenone,1-4-trifluoromethoxy phenyl ethanone,4-trifluoromethoxy acetophenone,1-4-trifluoromethoxy phenyl ethan-1-one,4'-trifluoromethoxyacetophenone,1-4-trifluoromethoxy-phenyl-ethanone,ethanone, 1-4-trifluoromethoxy phenyl,4-trifluoromethoxyacetophenone |
| IUPAC Name | 1-[4-(trifluoromethoxy)phenyl]ethanone |
| InChI Key | MOEXTBIPPMLEFX-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3O2 |
4-Methylmorpholine N-oxide monohydrate, 98+%
CAS: 70187-32-5 Molecular Formula: C5H13NO3 Molecular Weight (g/mol): 135.163 MDL Number: MFCD00149388 InChI Key: WAZPLXZGZWWXDQ-UHFFFAOYSA-N Synonym: 4-methylmorpholine n-oxide monohydrate,4-methylmorpholine 4-oxide hydrate,4-methylmorpholine n-oxide hydrate,4-methylmorpholine 4-oxide xhydrate,unii-087wu2ftq5,n-methylmorpholine n-oxide monohydrate,n-methylmorpholine n-oxide hydrate,n-methylmorpholine-n-oxide monohydrate,4-methyl-4-oxidomorpholin-4-ium hydrate,morpholine, 4-methyl-, 4-oxide, hydrate PubChem CID: 2724197 IUPAC Name: 4-methyl-4-oxidomorpholin-4-ium;hydrate SMILES: C[N+]1(CCOCC1)[O-].O
| PubChem CID | 2724197 |
|---|---|
| CAS | 70187-32-5 |
| Molecular Weight (g/mol) | 135.163 |
| MDL Number | MFCD00149388 |
| SMILES | C[N+]1(CCOCC1)[O-].O |
| Synonym | 4-methylmorpholine n-oxide monohydrate,4-methylmorpholine 4-oxide hydrate,4-methylmorpholine n-oxide hydrate,4-methylmorpholine 4-oxide xhydrate,unii-087wu2ftq5,n-methylmorpholine n-oxide monohydrate,n-methylmorpholine n-oxide hydrate,n-methylmorpholine-n-oxide monohydrate,4-methyl-4-oxidomorpholin-4-ium hydrate,morpholine, 4-methyl-, 4-oxide, hydrate |
| IUPAC Name | 4-methyl-4-oxidomorpholin-4-ium;hydrate |
| InChI Key | WAZPLXZGZWWXDQ-UHFFFAOYSA-N |
| Molecular Formula | C5H13NO3 |
2-Phenylpyrimidine-5-carbaldehyde, 97%, Thermo Scientific™
CAS: 130161-46-5 Molecular Formula: C11H8N2O Molecular Weight (g/mol): 184.198 MDL Number: MFCD03085924 InChI Key: AUTGLFSBJLERMV-UHFFFAOYSA-N Synonym: 2-phenyl-5-pyrimidinecarboxaldehye,2-phenylpyrimidine-5-carboxaldehyde,5-pyrimidinecarboxaldehyde, 2-phenyl,2-phenyl-pyrimidine-5-carbaldehyde,5-pyrimidinecarboxaldehyde,2-phenyl,2-phenyl-5-pyrimidinecarbaldehyde,2-phenyl-5-pyrimidinecarboxaldehyde,acmc-1c230,1-2-phenylpyrimidin-5-yl methanone PubChem CID: 820135 IUPAC Name: 2-phenylpyrimidine-5-carbaldehyde SMILES: C1=CC=C(C=C1)C2=NC=C(C=N2)C=O
| PubChem CID | 820135 |
|---|---|
| CAS | 130161-46-5 |
| Molecular Weight (g/mol) | 184.198 |
| MDL Number | MFCD03085924 |
| SMILES | C1=CC=C(C=C1)C2=NC=C(C=N2)C=O |
| Synonym | 2-phenyl-5-pyrimidinecarboxaldehye,2-phenylpyrimidine-5-carboxaldehyde,5-pyrimidinecarboxaldehyde, 2-phenyl,2-phenyl-pyrimidine-5-carbaldehyde,5-pyrimidinecarboxaldehyde,2-phenyl,2-phenyl-5-pyrimidinecarbaldehyde,2-phenyl-5-pyrimidinecarboxaldehyde,acmc-1c230,1-2-phenylpyrimidin-5-yl methanone |
| IUPAC Name | 2-phenylpyrimidine-5-carbaldehyde |
| InChI Key | AUTGLFSBJLERMV-UHFFFAOYSA-N |
| Molecular Formula | C11H8N2O |
6-Methoxy-2(3H)-benzoxazolone, 98+%
CAS: 532-91-2 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.148 MDL Number: MFCD00051726 InChI Key: MKMCJLMBVKHUMS-UHFFFAOYSA-N Synonym: coixol,6-methoxy-2-benzoxazolinone,6-methoxybenzo d oxazol-2 3h-one,6-methoxybenzoxazolinone,mboa,6-mboa,6-methoxy-2 3h-benzoxazolone,2-benzoxazolinone, 6-methoxy,2 3h-benzoxazolone, 6-methoxy,6-methoxy-1,3-benzoxazol-2 3h-one PubChem CID: 10772 IUPAC Name: 6-methoxy-3H-1,3-benzoxazol-2-one SMILES: COC1=CC2=C(C=C1)NC(=O)O2
| PubChem CID | 10772 |
|---|---|
| CAS | 532-91-2 |
| Molecular Weight (g/mol) | 165.148 |
| MDL Number | MFCD00051726 |
| SMILES | COC1=CC2=C(C=C1)NC(=O)O2 |
| Synonym | coixol,6-methoxy-2-benzoxazolinone,6-methoxybenzo d oxazol-2 3h-one,6-methoxybenzoxazolinone,mboa,6-mboa,6-methoxy-2 3h-benzoxazolone,2-benzoxazolinone, 6-methoxy,2 3h-benzoxazolone, 6-methoxy,6-methoxy-1,3-benzoxazol-2 3h-one |
| IUPAC Name | 6-methoxy-3H-1,3-benzoxazol-2-one |
| InChI Key | MKMCJLMBVKHUMS-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO3 |