Organic acids and derivatives
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Allyl acetate, 99%
CAS: 591-87-7 MDL Number: MFCD00008721 InChI Key: FWZUNOYOVVKUNF-UHFFFAOYSA-N Synonym: allyl acetate,3-acetoxypropene,acetic acid, 2-propenyl ester,2-propenyl acetate,2-propenyl ethanoate,3-acetoxy-1-propene,allylacetate,acetic acid, allyl ester,2-propenyl methanoate,unii-e4u5e5990i PubChem CID: 11584 IUPAC Name: prop-2-enyl acetate SMILES: CC(=O)OCC=C
| PubChem CID | 11584 |
|---|---|
| CAS | 591-87-7 |
| MDL Number | MFCD00008721 |
| SMILES | CC(=O)OCC=C |
| Synonym | allyl acetate,3-acetoxypropene,acetic acid, 2-propenyl ester,2-propenyl acetate,2-propenyl ethanoate,3-acetoxy-1-propene,allylacetate,acetic acid, allyl ester,2-propenyl methanoate,unii-e4u5e5990i |
| IUPAC Name | prop-2-enyl acetate |
| InChI Key | FWZUNOYOVVKUNF-UHFFFAOYSA-N |
Sodium 1-Heptanesulfonate 98.0+%, TCI America™
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CAS: 22767-50-6 Molecular Formula: C7H15NaO3S Molecular Weight (g/mol): 202.244 MDL Number: MFCD00007543 InChI Key: REFMEZARFCPESH-UHFFFAOYSA-M Synonym: sodium 1-heptanesulfonate,sodium heptane-1-sulfonate,1-heptanesulfonic acid sodium salt,1-heptanesulfonic acid, sodium salt,sodium heptane-1-sulphonate,1-heptanesulfonic acid, sodium salt 1:1,1-heptanesulfonic acid sodium,sodium heptanesulfonate,1-heptylsodiumsulfonate,sodium heptane sulfonate PubChem CID: 23672332 IUPAC Name: sodium;heptane-1-sulfonate SMILES: CCCCCCCS(=O)(=O)[O-].[Na+]
| PubChem CID | 23672332 |
|---|---|
| CAS | 22767-50-6 |
| Molecular Weight (g/mol) | 202.244 |
| MDL Number | MFCD00007543 |
| SMILES | CCCCCCCS(=O)(=O)[O-].[Na+] |
| Synonym | sodium 1-heptanesulfonate,sodium heptane-1-sulfonate,1-heptanesulfonic acid sodium salt,1-heptanesulfonic acid, sodium salt,sodium heptane-1-sulphonate,1-heptanesulfonic acid, sodium salt 1:1,1-heptanesulfonic acid sodium,sodium heptanesulfonate,1-heptylsodiumsulfonate,sodium heptane sulfonate |
| IUPAC Name | sodium;heptane-1-sulfonate |
| InChI Key | REFMEZARFCPESH-UHFFFAOYSA-M |
| Molecular Formula | C7H15NaO3S |
Fasudil monohydrochloride, 99+%
CAS: 105628-07-7 Molecular Formula: C14H18ClN3O2S Molecular Weight (g/mol): 327.827 MDL Number: MFCD00943198 InChI Key: LFVPBERIVUNMGV-UHFFFAOYSA-N Synonym: fasudil hydrochloride,fasudil hcl,eril,at 877 hydrochloride,fasudil monohydrochloride,ha 1077 hydrochloride,unii-sq04n8s7br,5-1,4-diazepan-1-yl sulfonyl isoquinoline hydrochloride,sq04n8s7br PubChem CID: 163751 IUPAC Name: 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride SMILES: C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl
| PubChem CID | 163751 |
|---|---|
| CAS | 105628-07-7 |
| Molecular Weight (g/mol) | 327.827 |
| MDL Number | MFCD00943198 |
| SMILES | C1CNCCN(C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl |
| Synonym | fasudil hydrochloride,fasudil hcl,eril,at 877 hydrochloride,fasudil monohydrochloride,ha 1077 hydrochloride,unii-sq04n8s7br,5-1,4-diazepan-1-yl sulfonyl isoquinoline hydrochloride,sq04n8s7br |
| IUPAC Name | 5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride |
| InChI Key | LFVPBERIVUNMGV-UHFFFAOYSA-N |
| Molecular Formula | C14H18ClN3O2S |
2-Phenylethyl Acetate 98.0+%, TCI America™
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CAS: 103-45-7 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008720 InChI Key: MDHYEMXUFSJLGV-UHFFFAOYSA-N Synonym: phenethyl acetate,2-phenethyl acetate,acetic acid, 2-phenylethyl ester,benzylcarbinyl acetate,beta-phenylethyl acetate,acetic acid, phenethyl ester,phenethyl alcohol, acetate,phenylethyl acetate,acetic acid phenethyl ester,ethanol, 2-phenyl-, acetate PubChem CID: 7654 ChEBI: CHEBI:31988 IUPAC Name: 2-phenylethyl acetate SMILES: CC(=O)OCCC1=CC=CC=C1
| PubChem CID | 7654 |
|---|---|
| CAS | 103-45-7 |
| Molecular Weight (g/mol) | 164.20 |
| ChEBI | CHEBI:31988 |
| MDL Number | MFCD00008720 |
| SMILES | CC(=O)OCCC1=CC=CC=C1 |
| Synonym | phenethyl acetate,2-phenethyl acetate,acetic acid, 2-phenylethyl ester,benzylcarbinyl acetate,beta-phenylethyl acetate,acetic acid, phenethyl ester,phenethyl alcohol, acetate,phenylethyl acetate,acetic acid phenethyl ester,ethanol, 2-phenyl-, acetate |
| IUPAC Name | 2-phenylethyl acetate |
| InChI Key | MDHYEMXUFSJLGV-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
Methyl Cinnamate 99.0+%, TCI America™
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CAS: 103-26-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00008458 InChI Key: CCRCUPLGCSFEDV-BQYQJAHWSA-N Synonym: methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate PubChem CID: 637520 ChEBI: CHEBI:6857 IUPAC Name: methyl (E)-3-phenylprop-2-enoate SMILES: COC(=O)C=CC1=CC=CC=C1
| PubChem CID | 637520 |
|---|---|
| CAS | 103-26-4 |
| Molecular Weight (g/mol) | 162.188 |
| ChEBI | CHEBI:6857 |
| MDL Number | MFCD00008458 |
| SMILES | COC(=O)C=CC1=CC=CC=C1 |
| Synonym | methyl cinnamate,methyl trans-cinnamate,methyl e-cinnamate,cinnamic acid methyl ester,methyl cinnamylate,methyl 3-phenylacrylate,methyl e-3-phenylprop-2-enoate,methyl 3-phenylpropenoate,trans-cinnamic acid methyl ester,trans-methyl cinnamate |
| IUPAC Name | methyl (E)-3-phenylprop-2-enoate |
| InChI Key | CCRCUPLGCSFEDV-BQYQJAHWSA-N |
| Molecular Formula | C10H10O2 |
Hydrazine acetate, 97%
CAS: 7335-65-1 Molecular Formula: C2H8N2O2 Molecular Weight (g/mol): 92.10 MDL Number: MFCD00013141 InChI Key: YFHNDHXQDJQEEE-UHFFFAOYSA-N Synonym: hydrazine acetate,hydrazinium acetate,hydrazine, monoacetate,hydrazine monoacetate,acetic acid; hydrazine,hydrazineacetate,hydrazine, acetate 1:1,acetic acid; diamine,hydrazine mono-acetate,acmc-209bph PubChem CID: 165591 IUPAC Name: acetic acid;hydrazine SMILES: NN.CC(O)=O
| PubChem CID | 165591 |
|---|---|
| CAS | 7335-65-1 |
| Molecular Weight (g/mol) | 92.10 |
| MDL Number | MFCD00013141 |
| SMILES | NN.CC(O)=O |
| Synonym | hydrazine acetate,hydrazinium acetate,hydrazine, monoacetate,hydrazine monoacetate,acetic acid; hydrazine,hydrazineacetate,hydrazine, acetate 1:1,acetic acid; diamine,hydrazine mono-acetate,acmc-209bph |
| IUPAC Name | acetic acid;hydrazine |
| InChI Key | YFHNDHXQDJQEEE-UHFFFAOYSA-N |
| Molecular Formula | C2H8N2O2 |
trans-10-Hydroxy-2-decenoic Acid 97.0+%, TCI America™
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CAS: 14113-05-4 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.25 MDL Number: MFCD00204506 InChI Key: QHBZHVUGQROELI-SOFGYWHQSA-N PubChem CID: 5312738 ChEBI: CHEBI:78668 IUPAC Name: (2E)-10-hydroxydec-2-enoic acid SMILES: OCCCCCCC\C=C\C(O)=O
| PubChem CID | 5312738 |
|---|---|
| CAS | 14113-05-4 |
| Molecular Weight (g/mol) | 186.25 |
| ChEBI | CHEBI:78668 |
| MDL Number | MFCD00204506 |
| SMILES | OCCCCCCC\C=C\C(O)=O |
| IUPAC Name | (2E)-10-hydroxydec-2-enoic acid |
| InChI Key | QHBZHVUGQROELI-SOFGYWHQSA-N |
| Molecular Formula | C10H18O3 |
Thermo Scientific Chemicals Ethylenediaminetetraacetic acid, tripotassium salt dihydrate, 99+%
CAS: 65501-24-8 Molecular Formula: C10H13K3N2O8·2H2O Molecular Weight (g/mol): 442.56 InChI Key: MAPFUJCWRWFQIY-UHFFFAOYSA-K Synonym: ethylenediaminetetraacetic acid tripotassium salt dihydrate,edta tripotassium salt,edta tripotassium salt dihydrate,tripotassium ethylenediaminetetraacetate dihydrate,potassium 2,2'-2-carboxylatomethyl carboxymethyl amino ethyl azanediyl diacetate dihydrate,tripotassium 2-2-bis carboxylatomethyl amino ethyl carboxymethyl amino acetate dihydrate,edta tripotassium salt, dihydrate,ethylenediaminetetraacetic acid, tripotassium salt dihydrate,ethylenediaminetetraacetic acid tripotassium salt dihydrate titration PubChem CID: 2733162 IUPAC Name: tripotassium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxymethyl)amino]acetate;dihydrate SMILES: C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].O.O.[K+].[K+].[K+]
| PubChem CID | 2733162 |
|---|---|
| CAS | 65501-24-8 |
| Molecular Weight (g/mol) | 442.56 |
| SMILES | C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].O.O.[K+].[K+].[K+] |
| Synonym | ethylenediaminetetraacetic acid tripotassium salt dihydrate,edta tripotassium salt,edta tripotassium salt dihydrate,tripotassium ethylenediaminetetraacetate dihydrate,potassium 2,2'-2-carboxylatomethyl carboxymethyl amino ethyl azanediyl diacetate dihydrate,tripotassium 2-2-bis carboxylatomethyl amino ethyl carboxymethyl amino acetate dihydrate,edta tripotassium salt, dihydrate,ethylenediaminetetraacetic acid, tripotassium salt dihydrate,ethylenediaminetetraacetic acid tripotassium salt dihydrate titration |
| IUPAC Name | tripotassium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxymethyl)amino]acetate;dihydrate |
| InChI Key | MAPFUJCWRWFQIY-UHFFFAOYSA-K |
| Molecular Formula | C10H13K3N2O8·2H2O |
Trifluoromethanesulfonic acid, 98+%
CAS: 1493-13-6 Molecular Formula: CHF3O3S Molecular Weight (g/mol): 150.07 MDL Number: MFCD00007514 InChI Key: ITMCEJHCFYSIIV-UHFFFAOYSA-N Synonym: triflic acid,perfluoromethanesulfonic acid,trifluoromethanesulphonic acid,tfmsa,trifluoromethane sulfonic acid,tfoh,methanesulfonic acid, trifluoro,hotf,trifluoromethylsulfonic acid,trimsylate PubChem CID: 62406 ChEBI: CHEBI:48511 IUPAC Name: trifluoromethanesulfonic acid SMILES: OS(=O)(=O)C(F)(F)F
| PubChem CID | 62406 |
|---|---|
| CAS | 1493-13-6 |
| Molecular Weight (g/mol) | 150.07 |
| ChEBI | CHEBI:48511 |
| MDL Number | MFCD00007514 |
| SMILES | OS(=O)(=O)C(F)(F)F |
| Synonym | triflic acid,perfluoromethanesulfonic acid,trifluoromethanesulphonic acid,tfmsa,trifluoromethane sulfonic acid,tfoh,methanesulfonic acid, trifluoro,hotf,trifluoromethylsulfonic acid,trimsylate |
| IUPAC Name | trifluoromethanesulfonic acid |
| InChI Key | ITMCEJHCFYSIIV-UHFFFAOYSA-N |
| Molecular Formula | CHF3O3S |
4'-Bromoacetanilide, 98%
CAS: 103-88-8 Molecular Formula: C8H8BrNO Molecular Weight (g/mol): 214.06 MDL Number: MFCD00000092 InChI Key: MSLICLMCQYQNPK-UHFFFAOYSA-N Synonym: 4'-bromoacetanilide,n-4-bromophenyl acetamide,p-bromoacetanilide,4-bromoacetanilide,bromoanilide,acetamide, n-4-bromophenyl,antisepsin,bromoantifebrin,asepsin,p-bromo-n-acetanilide PubChem CID: 7683 IUPAC Name: N-(4-bromophenyl)acetamide SMILES: CC(=O)NC1=CC=C(Br)C=C1
| PubChem CID | 7683 |
|---|---|
| CAS | 103-88-8 |
| Molecular Weight (g/mol) | 214.06 |
| MDL Number | MFCD00000092 |
| SMILES | CC(=O)NC1=CC=C(Br)C=C1 |
| Synonym | 4'-bromoacetanilide,n-4-bromophenyl acetamide,p-bromoacetanilide,4-bromoacetanilide,bromoanilide,acetamide, n-4-bromophenyl,antisepsin,bromoantifebrin,asepsin,p-bromo-n-acetanilide |
| IUPAC Name | N-(4-bromophenyl)acetamide |
| InChI Key | MSLICLMCQYQNPK-UHFFFAOYSA-N |
| Molecular Formula | C8H8BrNO |
N,N-Diethylformamide, 99%
CAS: 617-84-5 Molecular Formula: C5H11NO Molecular Weight (g/mol): 101.15 MDL Number: MFCD00003287 InChI Key: SUAKHGWARZSWIH-UHFFFAOYSA-N Synonym: diethylformamide,formamide, n,n-diethyl,n-formyldiethylamine,diethyl formamide,formyldiethylamine,diethylamid kyseliny mravenci,n,n-diethylcarboxamide,diethylamid kyseliny mravenci czech,diethyl-formamide,formamide, diethyl PubChem CID: 12051 IUPAC Name: N,N-diethylformamide SMILES: CCN(CC)C=O
| PubChem CID | 12051 |
|---|---|
| CAS | 617-84-5 |
| Molecular Weight (g/mol) | 101.15 |
| MDL Number | MFCD00003287 |
| SMILES | CCN(CC)C=O |
| Synonym | diethylformamide,formamide, n,n-diethyl,n-formyldiethylamine,diethyl formamide,formyldiethylamine,diethylamid kyseliny mravenci,n,n-diethylcarboxamide,diethylamid kyseliny mravenci czech,diethyl-formamide,formamide, diethyl |
| IUPAC Name | N,N-diethylformamide |
| InChI Key | SUAKHGWARZSWIH-UHFFFAOYSA-N |
| Molecular Formula | C5H11NO |
Dimethyl carbonate, 99%
CAS: 616-38-6 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.08 MDL Number: MFCD00008420 InChI Key: IEJIGPNLZYLLBP-UHFFFAOYSA-N Synonym: methyl carbonate,carbonic acid, dimethyl ester,carbonic acid dimethyl ester,methyl carbonate meo 2co,unii-ke9j097spn,dimethylcarbonate,ch3ocooch3,ke9j097spn,dimethyl ester of carbonic acid,dsstox_cid_9192 PubChem CID: 12021 ChEBI: CHEBI:36596 IUPAC Name: dimethyl carbonate SMILES: COC(=O)OC
| PubChem CID | 12021 |
|---|---|
| CAS | 616-38-6 |
| Molecular Weight (g/mol) | 90.08 |
| ChEBI | CHEBI:36596 |
| MDL Number | MFCD00008420 |
| SMILES | COC(=O)OC |
| Synonym | methyl carbonate,carbonic acid, dimethyl ester,carbonic acid dimethyl ester,methyl carbonate meo 2co,unii-ke9j097spn,dimethylcarbonate,ch3ocooch3,ke9j097spn,dimethyl ester of carbonic acid,dsstox_cid_9192 |
| IUPAC Name | dimethyl carbonate |
| InChI Key | IEJIGPNLZYLLBP-UHFFFAOYSA-N |
| Molecular Formula | C3H6O3 |
Sodium Thioglycolate 93.0+%, TCI America™
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CAS: 367-51-1 Molecular Formula: C2H3NaO2S Molecular Weight (g/mol): 114.094 MDL Number: MFCD00043386 InChI Key: GNBVPFITFYNRCN-UHFFFAOYSA-M Synonym: sodium thioglycolate,sodium mercaptoacetate,mercaptoacetic acid sodium salt,mollescal sf,sodium 2-sulfanylacetate,thioglycolate sodium,sodium thioglycollate,mercaptoacetic acid, sodium salt,erhavit d,sodium 2-mercatoethanoate PubChem CID: 23690444 ChEBI: CHEBI:86481 IUPAC Name: sodium;2-sulfanylacetate SMILES: C(C(=O)[O-])S.[Na+]
| PubChem CID | 23690444 |
|---|---|
| CAS | 367-51-1 |
| Molecular Weight (g/mol) | 114.094 |
| ChEBI | CHEBI:86481 |
| MDL Number | MFCD00043386 |
| SMILES | C(C(=O)[O-])S.[Na+] |
| Synonym | sodium thioglycolate,sodium mercaptoacetate,mercaptoacetic acid sodium salt,mollescal sf,sodium 2-sulfanylacetate,thioglycolate sodium,sodium thioglycollate,mercaptoacetic acid, sodium salt,erhavit d,sodium 2-mercatoethanoate |
| IUPAC Name | sodium;2-sulfanylacetate |
| InChI Key | GNBVPFITFYNRCN-UHFFFAOYSA-M |
| Molecular Formula | C2H3NaO2S |
kappa-Carrageenan
CAS: 11114-20-8 Molecular Formula: C24H36O25S2-2 Molecular Weight (g/mol): 788.647 MDL Number: MFCD00081480 InChI Key: ZNOZWUKQPJXOIG-XSBHQQIPSA-L Synonym: kappa-carrageenan,kappa-carrageenans,1->4-3,6-anhydro-alpha-d-galactopyranosyl-1->3-4-o-sulfonato-beta-d-galactopyranan PubChem CID: 11966249 IUPAC Name: [(2R,3S,4R,5R,6S)-6-[[(1R,3S,4R,5R,8S)-3,4-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-4-[[(1R,3R,4R,5R,8S)-8-[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-2-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-5-hydroxy-2-( SMILES: C1C2C(C(O1)C(C(O2)O)O)OC3C(C(C(C(O3)CO)OS(=O)(=O)[O-])OC4C(C5C(C(O4)CO5)OC6C(C(C(C(O6)CO)OS(=O)(=O)[O-])O)O)O)O
| PubChem CID | 11966249 |
|---|---|
| CAS | 11114-20-8 |
| Molecular Weight (g/mol) | 788.647 |
| MDL Number | MFCD00081480 |
| SMILES | C1C2C(C(O1)C(C(O2)O)O)OC3C(C(C(C(O3)CO)OS(=O)(=O)[O-])OC4C(C5C(C(O4)CO5)OC6C(C(C(C(O6)CO)OS(=O)(=O)[O-])O)O)O)O |
| Synonym | kappa-carrageenan,kappa-carrageenans,1->4-3,6-anhydro-alpha-d-galactopyranosyl-1->3-4-o-sulfonato-beta-d-galactopyranan |
| IUPAC Name | [(2R,3S,4R,5R,6S)-6-[[(1R,3S,4R,5R,8S)-3,4-dihydroxy-2,6-dioxabicyclo[3.2.1]octan-8-yl]oxy]-4-[[(1R,3R,4R,5R,8S)-8-[(2S,3R,4R,5R,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-sulfonatooxyoxan-2-yl]oxy-4-hydroxy-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy]-5-hydroxy-2-( |
| InChI Key | ZNOZWUKQPJXOIG-XSBHQQIPSA-L |
| Molecular Formula | C24H36O25S2-2 |
Isopropyl acetate, 99+%, pure
CAS: 108-21-4 MDL Number: MFCD00008877 InChI Key: JMMWKPVZQRWMSS-UHFFFAOYSA-N Synonym: isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester PubChem CID: 7915 IUPAC Name: propan-2-yl acetate SMILES: CC(C)OC(=O)C
| PubChem CID | 7915 |
|---|---|
| CAS | 108-21-4 |
| MDL Number | MFCD00008877 |
| SMILES | CC(C)OC(=O)C |
| Synonym | isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester |
| IUPAC Name | propan-2-yl acetate |
| InChI Key | JMMWKPVZQRWMSS-UHFFFAOYSA-N |