Organic compounds
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5-Bromo-2-fluorobenzaldehyde 95.0+%, TCI America™
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CAS: 93777-26-5 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00070755 InChI Key: MMFGGDVQLQQQRX-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t PubChem CID: 736327 IUPAC Name: 5-bromo-2-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1Br)C=O)F
| PubChem CID | 736327 |
|---|---|
| CAS | 93777-26-5 |
| Molecular Weight (g/mol) | 203.01 |
| MDL Number | MFCD00070755 |
| SMILES | C1=CC(=C(C=C1Br)C=O)F |
| Synonym | 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t |
| IUPAC Name | 5-bromo-2-fluorobenzaldehyde |
| InChI Key | MMFGGDVQLQQQRX-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrFO |
tert-Butyl 3-Oxopiperazine-1-carboxylate 98.0+%, TCI America™
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CAS: 76003-29-7 Molecular Formula: C9H16N2O3 Molecular Weight (g/mol): 200.238 MDL Number: MFCD02181069 InChI Key: FCMLWBBLOASUSO-UHFFFAOYSA-N Synonym: 1-boc-3-oxopiperazine,4-n-boc-2-oxo-piperazine,4-boc-piperazinone,n-boc-3-oxopiperazine,3-oxo-piperazine-1-carboxylic acid tert-butyl ester,tert-butyl 3-oxo-1-piperazinecarboxylate,4-n-boc-piperazin-2-one,n-boc-piperazin-3-one,1-piperazinecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-3-oxopiperazine PubChem CID: 3157178 IUPAC Name: tert-butyl 3-oxopiperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCNC(=O)C1
| PubChem CID | 3157178 |
|---|---|
| CAS | 76003-29-7 |
| Molecular Weight (g/mol) | 200.238 |
| MDL Number | MFCD02181069 |
| SMILES | CC(C)(C)OC(=O)N1CCNC(=O)C1 |
| Synonym | 1-boc-3-oxopiperazine,4-n-boc-2-oxo-piperazine,4-boc-piperazinone,n-boc-3-oxopiperazine,3-oxo-piperazine-1-carboxylic acid tert-butyl ester,tert-butyl 3-oxo-1-piperazinecarboxylate,4-n-boc-piperazin-2-one,n-boc-piperazin-3-one,1-piperazinecarboxylic acid, 3-oxo-, 1,1-dimethylethyl ester,1-tert-butoxycarbonyl-3-oxopiperazine |
| IUPAC Name | tert-butyl 3-oxopiperazine-1-carboxylate |
| InChI Key | FCMLWBBLOASUSO-UHFFFAOYSA-N |
| Molecular Formula | C9H16N2O3 |
[1,2-Bis(diphenylphosphino)ethane]palladium(II) Dichloride 98.0+%, TCI America™
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CAS: 19978-61-1 Molecular Formula: C26H26Cl2P2Pd+2 Molecular Weight (g/mol): 577.762 MDL Number: MFCD00015702 InChI Key: LDJXFZUGZASGIW-UHFFFAOYSA-N Synonym: dichloro 1,2-bis diphenylphosphino ethane palladium ii PubChem CID: 131675886 IUPAC Name: 2-diphenylphosphanylethyl(diphenyl)phosphane;palladium(2+);dihydrochloride SMILES: C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl.[Pd+2]
| PubChem CID | 131675886 |
|---|---|
| CAS | 19978-61-1 |
| Molecular Weight (g/mol) | 577.762 |
| MDL Number | MFCD00015702 |
| SMILES | C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl.[Pd+2] |
| Synonym | dichloro 1,2-bis diphenylphosphino ethane palladium ii |
| IUPAC Name | 2-diphenylphosphanylethyl(diphenyl)phosphane;palladium(2+);dihydrochloride |
| InChI Key | LDJXFZUGZASGIW-UHFFFAOYSA-N |
| Molecular Formula | C26H26Cl2P2Pd+2 |
Diethyl Vinylphosphonate 98.0+%, TCI America™
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CAS: 682-30-4 Molecular Formula: C6H13O3P Molecular Weight (g/mol): 164.14 MDL Number: MFCD00009079 InChI Key: DREPONDJUKIQLX-UHFFFAOYSA-N Synonym: diethyl vinylphosphonate,vinylphosphonic acid diethyl ester,diethyl vinylphosphate,diethoxyphosphinylethene,phosphonic acid, vinyl-, diethyl ester,diethyl ethenylphosphonate,phosphonic acid, ethenyl-, diethyl ester,1-ethenyl ethoxy phosphoryl oxyethane,acmc-1at5g PubChem CID: 69629 IUPAC Name: diethyl ethenylphosphonate SMILES: CCOP(=O)(OCC)C=C
| PubChem CID | 69629 |
|---|---|
| CAS | 682-30-4 |
| Molecular Weight (g/mol) | 164.14 |
| MDL Number | MFCD00009079 |
| SMILES | CCOP(=O)(OCC)C=C |
| Synonym | diethyl vinylphosphonate,vinylphosphonic acid diethyl ester,diethyl vinylphosphate,diethoxyphosphinylethene,phosphonic acid, vinyl-, diethyl ester,diethyl ethenylphosphonate,phosphonic acid, ethenyl-, diethyl ester,1-ethenyl ethoxy phosphoryl oxyethane,acmc-1at5g |
| IUPAC Name | diethyl ethenylphosphonate |
| InChI Key | DREPONDJUKIQLX-UHFFFAOYSA-N |
| Molecular Formula | C6H13O3P |
O-tert-Butyl-L-serine Methyl Ester Hydrochloride 98.0+%, TCI America™
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CAS: 17114-97-5 Molecular Formula: C8H18ClNO3 Molecular Weight (g/mol): 211.69 MDL Number: MFCD00077108 InChI Key: PCIABNBULSRKSU-UHFFFAOYNA-N Synonym: h-ser tbu-ome.hcl,o-tert-butyl-l-serine methyl ester hydrochloride,h-ser tbu-ome hcl,s-methyl 2-amino-3-tert-butoxy propanoate hydrochloride,methyl o-tert-butyl-l-serinate hydrochloride,l-serine, o-1,1-dimethylethyl-, methyl ester, hydrochloride,methyl 2s-2-amino-3-tert-butoxy propanoate hydrochloride,ksc491o3r,h-ser tbu-och3 hydrochloride,s-methyl 2-amino-3-tert-butoxy propanoate hcl PubChem CID: 16218549 IUPAC Name: methyl 2-amino-3-(tert-butoxy)propanoate hydrochloride SMILES: Cl.COC(=O)C(N)COC(C)(C)C
| PubChem CID | 16218549 |
|---|---|
| CAS | 17114-97-5 |
| Molecular Weight (g/mol) | 211.69 |
| MDL Number | MFCD00077108 |
| SMILES | Cl.COC(=O)C(N)COC(C)(C)C |
| Synonym | h-ser tbu-ome.hcl,o-tert-butyl-l-serine methyl ester hydrochloride,h-ser tbu-ome hcl,s-methyl 2-amino-3-tert-butoxy propanoate hydrochloride,methyl o-tert-butyl-l-serinate hydrochloride,l-serine, o-1,1-dimethylethyl-, methyl ester, hydrochloride,methyl 2s-2-amino-3-tert-butoxy propanoate hydrochloride,ksc491o3r,h-ser tbu-och3 hydrochloride,s-methyl 2-amino-3-tert-butoxy propanoate hcl |
| IUPAC Name | methyl 2-amino-3-(tert-butoxy)propanoate hydrochloride |
| InChI Key | PCIABNBULSRKSU-UHFFFAOYNA-N |
| Molecular Formula | C8H18ClNO3 |
Ethyl 4-Bromo-3-methylbenzoate 98.0+%, TCI America™
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CAS: 160313-69-9 Molecular Formula: C10H11BrO2 Molecular Weight (g/mol): 243.10 MDL Number: MFCD00673007 InChI Key: GIGDAWLJINYIFV-UHFFFAOYSA-N Synonym: 4-Bromo-3-methylbenzoic Acid Ethyl Ester, Ethyl 4-Bromo-m-toluate, 4-Bromo-m-toluic Acid Ethyl Ester PubChem CID: 21729626 IUPAC Name: ethyl 4-bromo-3-methylbenzoate SMILES: CCOC(=O)C1=CC(C)=C(Br)C=C1
| PubChem CID | 21729626 |
|---|---|
| CAS | 160313-69-9 |
| Molecular Weight (g/mol) | 243.10 |
| MDL Number | MFCD00673007 |
| SMILES | CCOC(=O)C1=CC(C)=C(Br)C=C1 |
| Synonym | 4-Bromo-3-methylbenzoic Acid Ethyl Ester, Ethyl 4-Bromo-m-toluate, 4-Bromo-m-toluic Acid Ethyl Ester |
| IUPAC Name | ethyl 4-bromo-3-methylbenzoate |
| InChI Key | GIGDAWLJINYIFV-UHFFFAOYSA-N |
| Molecular Formula | C10H11BrO2 |
2-(2-Chloroethoxy)tetrahydro-2H-pyran 96.0+%, TCI America™
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CAS: 5631-96-9 Molecular Formula: C7H13ClO2 Molecular Weight (g/mol): 164.629 MDL Number: MFCD00142761 InChI Key: ZVVQFPGYDBUGQB-UHFFFAOYSA-N PubChem CID: 254951 IUPAC Name: 2-(2-chloroethoxy)oxane SMILES: C1CCOC(C1)OCCCl
| PubChem CID | 254951 |
|---|---|
| CAS | 5631-96-9 |
| Molecular Weight (g/mol) | 164.629 |
| MDL Number | MFCD00142761 |
| SMILES | C1CCOC(C1)OCCCl |
| IUPAC Name | 2-(2-chloroethoxy)oxane |
| InChI Key | ZVVQFPGYDBUGQB-UHFFFAOYSA-N |
| Molecular Formula | C7H13ClO2 |
3,7-Dithia-1,9-nonanediol 92.0+%, TCI America™
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CAS: 16260-48-3 Molecular Formula: C7H16O2S2 Molecular Weight (g/mol): 196.32 MDL Number: MFCD01098524 InChI Key: JIJWGPUMOGBVMQ-UHFFFAOYSA-N PubChem CID: 373735 IUPAC Name: 2-({3-[(2-hydroxyethyl)sulfanyl]propyl}sulfanyl)ethan-1-ol SMILES: OCCSCCCSCCO
| PubChem CID | 373735 |
|---|---|
| CAS | 16260-48-3 |
| Molecular Weight (g/mol) | 196.32 |
| MDL Number | MFCD01098524 |
| SMILES | OCCSCCCSCCO |
| IUPAC Name | 2-({3-[(2-hydroxyethyl)sulfanyl]propyl}sulfanyl)ethan-1-ol |
| InChI Key | JIJWGPUMOGBVMQ-UHFFFAOYSA-N |
| Molecular Formula | C7H16O2S2 |
2-Methyltetrahydrothiophene 98.0+%, TCI America™
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CAS: 1795-09-1 Molecular Formula: C5H10S Molecular Weight (g/mol): 102.20 MDL Number: MFCD00015539 InChI Key: AJPGNQYBSTXCJE-UHFFFAOYNA-N Synonym: 2-methyltetrahydrothiophene,thiophene, tetrahydro-2-methyl,tetrahydro-2-methylthiophene,thiophene, tetrahydromethyl,2-methylthiophane,2-methylthi-olane,pubchem12832,2-methylthiacyclopentane,acmc-209efp,2-methyl tetrahydrothiophene PubChem CID: 15711 IUPAC Name: 2-methylthiolane SMILES: CC1CCCS1
| PubChem CID | 15711 |
|---|---|
| CAS | 1795-09-1 |
| Molecular Weight (g/mol) | 102.20 |
| MDL Number | MFCD00015539 |
| SMILES | CC1CCCS1 |
| Synonym | 2-methyltetrahydrothiophene,thiophene, tetrahydro-2-methyl,tetrahydro-2-methylthiophene,thiophene, tetrahydromethyl,2-methylthiophane,2-methylthi-olane,pubchem12832,2-methylthiacyclopentane,acmc-209efp,2-methyl tetrahydrothiophene |
| IUPAC Name | 2-methylthiolane |
| InChI Key | AJPGNQYBSTXCJE-UHFFFAOYNA-N |
| Molecular Formula | C5H10S |
5-Chloro-2-(methylthio)benzothiazole 98.0+%, TCI America™
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CAS: 3507-41-3 Molecular Formula: C8H6ClNS2 Molecular Weight (g/mol): 215.713 InChI Key: YINRVZUJQJFNES-UHFFFAOYSA-N PubChem CID: 645746 IUPAC Name: 5-chloro-2-methylsulfanyl-1,3-benzothiazole SMILES: CSC1=NC2=C(S1)C=CC(=C2)Cl
| PubChem CID | 645746 |
|---|---|
| CAS | 3507-41-3 |
| Molecular Weight (g/mol) | 215.713 |
| SMILES | CSC1=NC2=C(S1)C=CC(=C2)Cl |
| IUPAC Name | 5-chloro-2-methylsulfanyl-1,3-benzothiazole |
| InChI Key | YINRVZUJQJFNES-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNS2 |
Fenticonazole Nitrate 97.0+%, TCI America™
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CAS: 73151-29-8 Molecular Formula: C24H21Cl2N3O4S Molecular Weight (g/mol): 518.41 MDL Number: MFCD00941391 InChI Key: FJNRUWDGCVDXLU-UHFFFAOYNA-N PubChem CID: 51754 ChEBI: CHEBI:83606 IUPAC Name: 1-[2-(2,4-dichlorophenyl)-2-{[4-(phenylsulfanyl)phenyl]methoxy}ethyl]-1H-imidazole; nitric acid SMILES: O[N+]([O-])=O.ClC1=CC=C(C(CN2C=CN=C2)OCC2=CC=C(SC3=CC=CC=C3)C=C2)C(Cl)=C1
| PubChem CID | 51754 |
|---|---|
| CAS | 73151-29-8 |
| Molecular Weight (g/mol) | 518.41 |
| ChEBI | CHEBI:83606 |
| MDL Number | MFCD00941391 |
| SMILES | O[N+]([O-])=O.ClC1=CC=C(C(CN2C=CN=C2)OCC2=CC=C(SC3=CC=CC=C3)C=C2)C(Cl)=C1 |
| IUPAC Name | 1-[2-(2,4-dichlorophenyl)-2-{[4-(phenylsulfanyl)phenyl]methoxy}ethyl]-1H-imidazole; nitric acid |
| InChI Key | FJNRUWDGCVDXLU-UHFFFAOYNA-N |
| Molecular Formula | C24H21Cl2N3O4S |
4-Bromo-2-furaldehyde 97.0+%, TCI America™
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CAS: 21921-76-6 Molecular Formula: C5H3BrO2 Molecular Weight (g/mol): 174.981 MDL Number: MFCD00671504 InChI Key: MRGBBKQOSUHKPF-UHFFFAOYSA-N Synonym: 4-bromo-2-furaldehyde,4-bromofurfural,4-bromo-2-formylfuran,4-bromo-2-furancarbaldehyde,2-furancarboxaldehyde, 4-bromo,4-bromo-furfural,4-bromofuraldehyde,zlchem 82,pubchem3545,acmc-209fpi PubChem CID: 2757010 IUPAC Name: 4-bromofuran-2-carbaldehyde SMILES: C1=C(OC=C1Br)C=O
| PubChem CID | 2757010 |
|---|---|
| CAS | 21921-76-6 |
| Molecular Weight (g/mol) | 174.981 |
| MDL Number | MFCD00671504 |
| SMILES | C1=C(OC=C1Br)C=O |
| Synonym | 4-bromo-2-furaldehyde,4-bromofurfural,4-bromo-2-formylfuran,4-bromo-2-furancarbaldehyde,2-furancarboxaldehyde, 4-bromo,4-bromo-furfural,4-bromofuraldehyde,zlchem 82,pubchem3545,acmc-209fpi |
| IUPAC Name | 4-bromofuran-2-carbaldehyde |
| InChI Key | MRGBBKQOSUHKPF-UHFFFAOYSA-N |
| Molecular Formula | C5H3BrO2 |
1,2-Bis(diphenylphosphino)benzene 98.0+%, TCI America™
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CAS: 13991-08-7 Molecular Formula: C30H24P2 Molecular Weight (g/mol): 446.47 MDL Number: MFCD00014081 InChI Key: NFRYVRNCDXULEX-UHFFFAOYSA-N Synonym: 1,2-bis diphenylphosphino benzene,dppbz,dppbe,dppben,dppbenz,o-bis diphenylphosphino benzene,1,2-bis dimethylphosphino benzene,o-phenylenebis diphenylphosphine,phosphine, phenylenebis diphenyl,1,2-bis diphenylphosphanyl benzene PubChem CID: 498379 IUPAC Name: [2-(diphenylphosphanyl)phenyl]diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 498379 |
|---|---|
| CAS | 13991-08-7 |
| Molecular Weight (g/mol) | 446.47 |
| MDL Number | MFCD00014081 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1,2-bis diphenylphosphino benzene,dppbz,dppbe,dppben,dppbenz,o-bis diphenylphosphino benzene,1,2-bis dimethylphosphino benzene,o-phenylenebis diphenylphosphine,phosphine, phenylenebis diphenyl,1,2-bis diphenylphosphanyl benzene |
| IUPAC Name | [2-(diphenylphosphanyl)phenyl]diphenylphosphane |
| InChI Key | NFRYVRNCDXULEX-UHFFFAOYSA-N |
| Molecular Formula | C30H24P2 |
Glucotropaeolin Potassium Salt 95.0+%, TCI America™
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CAS: 5115-71-9 Molecular Formula: C14H18KNO9S2 Molecular Weight (g/mol): 447.514 MDL Number: MFCD00153006 InChI Key: UYCWNAZWHVREMO-GYVLLFFHSA-M PubChem CID: 70702337 IUPAC Name: potassium;[(E)-[2-phenyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylethylidene]amino] sulfate SMILES: C1=CC=C(C=C1)CC(=NOS(=O)(=O)[O-])SC2C(C(C(C(O2)CO)O)O)O.[K+]
| PubChem CID | 70702337 |
|---|---|
| CAS | 5115-71-9 |
| Molecular Weight (g/mol) | 447.514 |
| MDL Number | MFCD00153006 |
| SMILES | C1=CC=C(C=C1)CC(=NOS(=O)(=O)[O-])SC2C(C(C(C(O2)CO)O)O)O.[K+] |
| IUPAC Name | potassium;[(E)-[2-phenyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylethylidene]amino] sulfate |
| InChI Key | UYCWNAZWHVREMO-GYVLLFFHSA-M |
| Molecular Formula | C14H18KNO9S2 |
Ranolazine Dihydrochloride 98.0+%, TCI America™
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CAS: 95635-56-6 Molecular Formula: C24H35Cl2N3O4 Molecular Weight (g/mol): 500.46 MDL Number: MFCD03788770 InChI Key: RJNSNFZXAZXOFX-UHFFFAOYNA-N Synonym: ranolazine dihydrochloride,ranolazine hcl,ranolazine hydrochloride,renolazine,n-2,6-dimethylphenyl-2-4-2-hydroxy-3-2-methoxyphenoxy propyl piperazin-1-yl acetamide dihydrochloride,ranolazine hydrochloride usan,ranolazine 2hcl,+--4-2-hydroxy-3-o-methoxyphenoxy propyl-1-piperazineaceto-2',6'-xylidide dihydrochloride PubChem CID: 71279 IUPAC Name: dihydrogen N-(2,6-dimethylphenyl)-2-{4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl}acetamide dichloride SMILES: [H+].[H+].[Cl-].[Cl-].COC1=CC=CC=C1OCC(O)CN1CCN(CC(=O)NC2=C(C)C=CC=C2C)CC1
| PubChem CID | 71279 |
|---|---|
| CAS | 95635-56-6 |
| Molecular Weight (g/mol) | 500.46 |
| MDL Number | MFCD03788770 |
| SMILES | [H+].[H+].[Cl-].[Cl-].COC1=CC=CC=C1OCC(O)CN1CCN(CC(=O)NC2=C(C)C=CC=C2C)CC1 |
| Synonym | ranolazine dihydrochloride,ranolazine hcl,ranolazine hydrochloride,renolazine,n-2,6-dimethylphenyl-2-4-2-hydroxy-3-2-methoxyphenoxy propyl piperazin-1-yl acetamide dihydrochloride,ranolazine hydrochloride usan,ranolazine 2hcl,+--4-2-hydroxy-3-o-methoxyphenoxy propyl-1-piperazineaceto-2',6'-xylidide dihydrochloride |
| IUPAC Name | dihydrogen N-(2,6-dimethylphenyl)-2-{4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl}acetamide dichloride |
| InChI Key | RJNSNFZXAZXOFX-UHFFFAOYNA-N |
| Molecular Formula | C24H35Cl2N3O4 |