Organic compounds
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Benzoyl chloride, 99.5+%, pure
CAS: 98-88-4 Molecular Formula: C7H5ClO Molecular Weight (g/mol): 140.57 MDL Number: MFCD00000653 InChI Key: PASDCCFISLVPSO-UHFFFAOYSA-N Synonym: benzenecarbonyl chloride,benzoic acid, chloride,benzoylchloride,alpha-chlorobenzaldehyde,benzoic acid chloride,benzoylchlorid,benzaldehyde, alpha-chloro,a-chlorobenzaldehyde,ccris 802,unii-vty8706w36 PubChem CID: 7412 ChEBI: CHEBI:82275 IUPAC Name: benzoyl chloride SMILES: C1=CC=C(C=C1)C(=O)Cl
| PubChem CID | 7412 |
|---|---|
| CAS | 98-88-4 |
| Molecular Weight (g/mol) | 140.57 |
| ChEBI | CHEBI:82275 |
| MDL Number | MFCD00000653 |
| SMILES | C1=CC=C(C=C1)C(=O)Cl |
| Synonym | benzenecarbonyl chloride,benzoic acid, chloride,benzoylchloride,alpha-chlorobenzaldehyde,benzoic acid chloride,benzoylchlorid,benzaldehyde, alpha-chloro,a-chlorobenzaldehyde,ccris 802,unii-vty8706w36 |
| IUPAC Name | benzoyl chloride |
| InChI Key | PASDCCFISLVPSO-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO |
Cyclohexanol, 98%
CAS: 108-93-0 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.16 InChI Key: HPXRVTGHNJAIIH-UHFFFAOYSA-N Synonym: cyclohexyl alcohol,hexahydrophenol,hydrophenol,hydroxycyclohexane,hexalin,1-cyclohexanol,hydralin,adronal,naxol,adronol PubChem CID: 7966 ChEBI: CHEBI:18099 IUPAC Name: cyclohexanol SMILES: C1CCC(CC1)O
| PubChem CID | 7966 |
|---|---|
| CAS | 108-93-0 |
| Molecular Weight (g/mol) | 100.16 |
| ChEBI | CHEBI:18099 |
| SMILES | C1CCC(CC1)O |
| Synonym | cyclohexyl alcohol,hexahydrophenol,hydrophenol,hydroxycyclohexane,hexalin,1-cyclohexanol,hydralin,adronal,naxol,adronol |
| IUPAC Name | cyclohexanol |
| InChI Key | HPXRVTGHNJAIIH-UHFFFAOYSA-N |
| Molecular Formula | C6H12O |
Dithiothreitol, >99.5%, Molecular Biology Grade, Ultrapure
CAS: 12-3-3483 Molecular Formula: C4H10O2S2 Molecular Weight (g/mol): 154.24 MDL Number: MFCD00004877 InChI Key: VHJLVAABSRFDPM-IMJSIDKUSA-N Synonym: dithiothreitol,dl-1,4-dithiothreitol,dl-dithiothreitol,1,4-dithio-dl-threitol,d-1,4-dithiothreitol,d-dtt,2s,3s-1,4-dimercaptobutane-2,3-diol,threo-1,4-dimercapto-2,3-butanediol,1,4-dithiothreitol,dtt PubChem CID: 446094 ChEBI: CHEBI:42170 IUPAC Name: (2 S,3 S)-1,4-bis(sulfanyl)butane-2,3-diol SMILES: C(C(C(CS)O)O)S
| PubChem CID | 446094 |
|---|---|
| CAS | 12-3-3483 |
| Molecular Weight (g/mol) | 154.24 |
| ChEBI | CHEBI:42170 |
| MDL Number | MFCD00004877 |
| SMILES | C(C(C(CS)O)O)S |
| Synonym | dithiothreitol,dl-1,4-dithiothreitol,dl-dithiothreitol,1,4-dithio-dl-threitol,d-1,4-dithiothreitol,d-dtt,2s,3s-1,4-dimercaptobutane-2,3-diol,threo-1,4-dimercapto-2,3-butanediol,1,4-dithiothreitol,dtt |
| IUPAC Name | (2 S,3 S)-1,4-bis(sulfanyl)butane-2,3-diol |
| InChI Key | VHJLVAABSRFDPM-IMJSIDKUSA-N |
| Molecular Formula | C4H10O2S2 |
1-Hexanesulfonic acid, sodium salt, 99+%, Ion pair chromatography, anhydrous
CAS: 2832-45-3 Molecular Formula: C6H13NaO3S Molecular Weight (g/mol): 188.22 MDL Number: MFCD00007542 InChI Key: QWSZRRAAFHGKCH-UHFFFAOYSA-M Synonym: sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt PubChem CID: 23677630 IUPAC Name: sodium;hexane-1-sulfonate SMILES: [Na+].CCCCCCS([O-])(=O)=O
| PubChem CID | 23677630 |
|---|---|
| CAS | 2832-45-3 |
| Molecular Weight (g/mol) | 188.22 |
| MDL Number | MFCD00007542 |
| SMILES | [Na+].CCCCCCS([O-])(=O)=O |
| Synonym | sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt |
| IUPAC Name | sodium;hexane-1-sulfonate |
| InChI Key | QWSZRRAAFHGKCH-UHFFFAOYSA-M |
| Molecular Formula | C6H13NaO3S |
Diethyl pyrocarbonate, 97%, pure
CAS: 1609-47-8 Molecular Formula: C6H10O5 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00009106 InChI Key: FFYPMLJYZAEMQB-UHFFFAOYSA-N Synonym: diethyl pyrocarbonate,diethyl dicarbonate,depc,diethyl oxydiformate,baycovin,diethylpyrocarbonate,ethyl pyrocarbonate,dicarbonic acid, diethyl ester,dicarbonic acid diethyl ester,diethyl pyrocarbonic acid PubChem CID: 3051 ChEBI: CHEBI:59051 IUPAC Name: ethoxycarbonyl ethyl carbonate SMILES: CCOC(=O)OC(=O)OCC
| PubChem CID | 3051 |
|---|---|
| CAS | 1609-47-8 |
| Molecular Weight (g/mol) | 162.14 |
| ChEBI | CHEBI:59051 |
| MDL Number | MFCD00009106 |
| SMILES | CCOC(=O)OC(=O)OCC |
| Synonym | diethyl pyrocarbonate,diethyl dicarbonate,depc,diethyl oxydiformate,baycovin,diethylpyrocarbonate,ethyl pyrocarbonate,dicarbonic acid, diethyl ester,dicarbonic acid diethyl ester,diethyl pyrocarbonic acid |
| IUPAC Name | ethoxycarbonyl ethyl carbonate |
| InChI Key | FFYPMLJYZAEMQB-UHFFFAOYSA-N |
| Molecular Formula | C6H10O5 |
| CAS | 9000-70-8 |
|---|---|
| MDL Number | MFCD00081638 |
1,4-Dimethoxybenzene, 99+%
CAS: 150-78-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008401 InChI Key: OHBQPCCCRFSCAX-UHFFFAOYSA-N Synonym: p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9 PubChem CID: 9016 IUPAC Name: 1,4-dimethoxybenzene SMILES: COC1=CC=C(OC)C=C1
| PubChem CID | 9016 |
|---|---|
| CAS | 150-78-7 |
| Molecular Weight (g/mol) | 138.17 |
| MDL Number | MFCD00008401 |
| SMILES | COC1=CC=C(OC)C=C1 |
| Synonym | p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9 |
| IUPAC Name | 1,4-dimethoxybenzene |
| InChI Key | OHBQPCCCRFSCAX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Thermo Scientific Chemicals Acarbose, 95%
CAS: 56180-94-0 Molecular Formula: C25H43NO18 Molecular Weight (g/mol): 645.608 MDL Number: MFCD00869592 InChI Key: XUFXOAAUWZOOIT-AKWDJIIVSA-N Synonym: acarbose PubChem CID: 131674886 IUPAC Name: (3S,5S)-5-[(2R,3S,5S)-5-[(2R,3S,5S)-3,4-dihydroxy-6-methyl-5-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol SMILES: CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)NC4C=C(C(C(C4O)O)O)CO
| PubChem CID | 131674886 |
|---|---|
| CAS | 56180-94-0 |
| Molecular Weight (g/mol) | 645.608 |
| MDL Number | MFCD00869592 |
| SMILES | CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)NC4C=C(C(C(C4O)O)O)CO |
| Synonym | acarbose |
| IUPAC Name | (3S,5S)-5-[(2R,3S,5S)-5-[(2R,3S,5S)-3,4-dihydroxy-6-methyl-5-[[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-(hydroxymethyl)oxane-2,3,4-triol |
| InChI Key | XUFXOAAUWZOOIT-AKWDJIIVSA-N |
| Molecular Formula | C25H43NO18 |
Semicarbazide hydrochloride, 99+%
CAS: 563-41-7 Molecular Formula: CH6ClN3O Molecular Weight (g/mol): 111.53 MDL Number: MFCD00013009 InChI Key: XHQYBDSXTDXSHY-UHFFFAOYSA-N Synonym: semicarbazide hydrochloride,aminourea hydrochloride,semicarbazide hcl,hydrazinecarboxamide hydrochloride,hydrazinecarboxamide, monohydrochloride,semicarbazide chloride,amidourea hydrochloride,carbamylhydrazine hydrochloride,semicarbazide monohydrochloride,semicarbazide, monohydrochloride PubChem CID: 11236 ChEBI: CHEBI:82532 IUPAC Name: aminourea;hydrochloride SMILES: [H+].[Cl-].NNC(N)=O
| PubChem CID | 11236 |
|---|---|
| CAS | 563-41-7 |
| Molecular Weight (g/mol) | 111.53 |
| ChEBI | CHEBI:82532 |
| MDL Number | MFCD00013009 |
| SMILES | [H+].[Cl-].NNC(N)=O |
| Synonym | semicarbazide hydrochloride,aminourea hydrochloride,semicarbazide hcl,hydrazinecarboxamide hydrochloride,hydrazinecarboxamide, monohydrochloride,semicarbazide chloride,amidourea hydrochloride,carbamylhydrazine hydrochloride,semicarbazide monohydrochloride,semicarbazide, monohydrochloride |
| IUPAC Name | aminourea;hydrochloride |
| InChI Key | XHQYBDSXTDXSHY-UHFFFAOYSA-N |
| Molecular Formula | CH6ClN3O |
Thermo Scientific Chemicals Curcumin (mixture of curcumin, demethoxycurcumin, and bisdemethoxycurcumin), 96%
CAS: 458-37-7 Molecular Formula: C21H20O6 Molecular Weight (g/mol): 368.39 MDL Number: MFCD00008365 InChI Key: ZIUSSTSXXLLKKK-KOBPDPAPSA-N Synonym: curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i PubChem CID: 969516 ChEBI: CHEBI:3962 SMILES: COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O
| PubChem CID | 969516 |
|---|---|
| CAS | 458-37-7 |
| Molecular Weight (g/mol) | 368.39 |
| ChEBI | CHEBI:3962 |
| MDL Number | MFCD00008365 |
| SMILES | COC1=CC(\C=C\C(\O)=C\C(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O |
| Synonym | curcumin,diferuloylmethane,natural yellow 3,turmeric yellow,turmeric,curcuma,kacha haldi,gelbwurz,halad,curcumin i |
| InChI Key | ZIUSSTSXXLLKKK-KOBPDPAPSA-N |
| Molecular Formula | C21H20O6 |
Pyrogallol, ACS reagent
CAS: 87-66-1 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00002192 InChI Key: WQGWDDDVZFFDIG-UHFFFAOYSA-N Synonym: pyrogallol,1,2,3-trihydroxybenzene,pyrogallic acid,1,2,3-benzenetriol,fouramine brown ap,fourrine pg,fourrine 85,pyro,c.i. oxidation base 32,piral PubChem CID: 1057 ChEBI: CHEBI:16164 IUPAC Name: benzene-1,2,3-triol SMILES: OC1=CC=CC(O)=C1O
| PubChem CID | 1057 |
|---|---|
| CAS | 87-66-1 |
| Molecular Weight (g/mol) | 126.11 |
| ChEBI | CHEBI:16164 |
| MDL Number | MFCD00002192 |
| SMILES | OC1=CC=CC(O)=C1O |
| Synonym | pyrogallol,1,2,3-trihydroxybenzene,pyrogallic acid,1,2,3-benzenetriol,fouramine brown ap,fourrine pg,fourrine 85,pyro,c.i. oxidation base 32,piral |
| IUPAC Name | benzene-1,2,3-triol |
| InChI Key | WQGWDDDVZFFDIG-UHFFFAOYSA-N |
| Molecular Formula | C6H6O3 |
Starch, ACS reagent, soluble
CAS: 9005-84-9 Molecular Formula: C12H22O11 Molecular Weight (g/mol): 342.297 MDL Number: MFCD00082026 InChI Key: GUBGYTABKSRVRQ-ASMJPISFSA-N Synonym: alpha-maltose,maltose,starch, soluble,glcalpha1-4glca,unii-15sug9ad26,glcalpha1-4glcalpha,amylodextrin,starch solution,alpha-malt sugar,4-o-alpha-d-glucopyranosyl-alpha-d-glucopyranose PubChem CID: 439341 ChEBI: CHEBI:18167 IUPAC Name: (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol SMILES: C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O
| PubChem CID | 439341 |
|---|---|
| CAS | 9005-84-9 |
| Molecular Weight (g/mol) | 342.297 |
| ChEBI | CHEBI:18167 |
| MDL Number | MFCD00082026 |
| SMILES | C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O |
| Synonym | alpha-maltose,maltose,starch, soluble,glcalpha1-4glca,unii-15sug9ad26,glcalpha1-4glcalpha,amylodextrin,starch solution,alpha-malt sugar,4-o-alpha-d-glucopyranosyl-alpha-d-glucopyranose |
| IUPAC Name | (2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6S)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol |
| InChI Key | GUBGYTABKSRVRQ-ASMJPISFSA-N |
| Molecular Formula | C12H22O11 |
| CAS | 9000-01-5 |
|---|---|
| MDL Number | MFCD00081264 |
| Synonym | Acacia |
n-Butyl sulfide, 99%, pure
CAS: 544-40-1 Molecular Formula: C8H18S Molecular Weight (g/mol): 146.29 MDL Number: MFCD00009468 InChI Key: HTIRHQRTDBPHNZ-UHFFFAOYSA-N Synonym: dibutyl sulfide,butyl sulfide,n-butyl sulfide,butylthiobutane,di-n-butyl sulfide,butane, 1,1'-thiobis,butyl monosulfide,dibutyl thioether,thiononane-5,n-dibutyl sulfide PubChem CID: 11002 SMILES: CCCCSCCCC
| PubChem CID | 11002 |
|---|---|
| CAS | 544-40-1 |
| Molecular Weight (g/mol) | 146.29 |
| MDL Number | MFCD00009468 |
| SMILES | CCCCSCCCC |
| Synonym | dibutyl sulfide,butyl sulfide,n-butyl sulfide,butylthiobutane,di-n-butyl sulfide,butane, 1,1'-thiobis,butyl monosulfide,dibutyl thioether,thiononane-5,n-dibutyl sulfide |
| InChI Key | HTIRHQRTDBPHNZ-UHFFFAOYSA-N |
| Molecular Formula | C8H18S |
epsilon-Caprolactam, 99+%
CAS: 105-60-2 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00006936 InChI Key: JBKVHLHDHHXQEQ-UHFFFAOYSA-N Synonym: epsilon-caprolactam,caprolactam,6-caprolactam,2-oxohexamethylenimine,aminocaproic lactam,2-azacycloheptanone,hexahydro-2h-azepin-2-one,2h-azepin-2-one, hexahydro,6-hexanelactam,hexanolactam PubChem CID: 7768 ChEBI: CHEBI:28579 IUPAC Name: azepan-2-one SMILES: C1CCC(=O)NCC1
| PubChem CID | 7768 |
|---|---|
| CAS | 105-60-2 |
| Molecular Weight (g/mol) | 113.16 |
| ChEBI | CHEBI:28579 |
| MDL Number | MFCD00006936 |
| SMILES | C1CCC(=O)NCC1 |
| Synonym | epsilon-caprolactam,caprolactam,6-caprolactam,2-oxohexamethylenimine,aminocaproic lactam,2-azacycloheptanone,hexahydro-2h-azepin-2-one,2h-azepin-2-one, hexahydro,6-hexanelactam,hexanolactam |
| IUPAC Name | azepan-2-one |
| InChI Key | JBKVHLHDHHXQEQ-UHFFFAOYSA-N |
| Molecular Formula | C6H11NO |