Organic acids and derivatives
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1-Naphthaleneboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 13922-41-3 Molecular Formula: C10H9BO2 Molecular Weight (g/mol): 171.99 MDL Number: MFCD00019722 InChI Key: HUMMCEUVDBVXTQ-UHFFFAOYSA-N Synonym: 1-naphthaleneboronic acid,1-naphthylboronic acid,naphthalene-1-boronic acid,naphthalenyl-1-boronic acid,1-naphthalene boronic acid,1-naphthaleneboronicacid,1-naphthyleneboronic acid,boronic acid, naphthalenyl,1-borononaphthalene,naphthylboronic acid PubChem CID: 254532 IUPAC Name: (naphthalen-1-yl)boronic acid SMILES: OB(O)C1=CC=CC2=CC=CC=C12
| PubChem CID | 254532 |
|---|---|
| CAS | 13922-41-3 |
| Molecular Weight (g/mol) | 171.99 |
| MDL Number | MFCD00019722 |
| SMILES | OB(O)C1=CC=CC2=CC=CC=C12 |
| Synonym | 1-naphthaleneboronic acid,1-naphthylboronic acid,naphthalene-1-boronic acid,naphthalenyl-1-boronic acid,1-naphthalene boronic acid,1-naphthaleneboronicacid,1-naphthyleneboronic acid,boronic acid, naphthalenyl,1-borononaphthalene,naphthylboronic acid |
| IUPAC Name | (naphthalen-1-yl)boronic acid |
| InChI Key | HUMMCEUVDBVXTQ-UHFFFAOYSA-N |
| Molecular Formula | C10H9BO2 |
(1alpha,3alpha,5alpha)-1,3,5-Cyclohexanetricarboxylic Acid 98.0+%, TCI America™
CAS: 16526-68-4 Molecular Formula: C9H12O6 Molecular Weight (g/mol): 216.189 MDL Number: MFCD00075294 InChI Key: FTHDNRBKSLBLDA-UHFFFAOYSA-N PubChem CID: 349732 IUPAC Name: cyclohexane-1,3,5-tricarboxylic acid SMILES: C1C(CC(CC1C(=O)O)C(=O)O)C(=O)O
| PubChem CID | 349732 |
|---|---|
| CAS | 16526-68-4 |
| Molecular Weight (g/mol) | 216.189 |
| MDL Number | MFCD00075294 |
| SMILES | C1C(CC(CC1C(=O)O)C(=O)O)C(=O)O |
| IUPAC Name | cyclohexane-1,3,5-tricarboxylic acid |
| InChI Key | FTHDNRBKSLBLDA-UHFFFAOYSA-N |
| Molecular Formula | C9H12O6 |
N,N'-Dibenzoylhydrazine 95.0+%, TCI America™
CAS: 787-84-8 Molecular Formula: C14H12N2O2 Molecular Weight (g/mol): 240.262 MDL Number: MFCD00003068 InChI Key: GRRIYLZJLGTQJX-UHFFFAOYSA-N Synonym: dibenzoylhydrazine,n,n'-dibenzoylhydrazine,1,2-dibenzoylhydrazine,benzoic acid, 2-benzoylhydrazide,n2-benzoylbenzoic acid hydrazide,hydrazine, 1,2-dibenzoyl,n,n-dibenzoylhydrazine,nn'-dibenzoylhydrazine,c6h5-co-nh-nh-co-c6h5,benzoic acid,2-benzoylhydrazide PubChem CID: 13085 ChEBI: CHEBI:38453 IUPAC Name: N'-benzoylbenzohydrazide SMILES: C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CC=C2
| PubChem CID | 13085 |
|---|---|
| CAS | 787-84-8 |
| Molecular Weight (g/mol) | 240.262 |
| ChEBI | CHEBI:38453 |
| MDL Number | MFCD00003068 |
| SMILES | C1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CC=C2 |
| Synonym | dibenzoylhydrazine,n,n'-dibenzoylhydrazine,1,2-dibenzoylhydrazine,benzoic acid, 2-benzoylhydrazide,n2-benzoylbenzoic acid hydrazide,hydrazine, 1,2-dibenzoyl,n,n-dibenzoylhydrazine,nn'-dibenzoylhydrazine,c6h5-co-nh-nh-co-c6h5,benzoic acid,2-benzoylhydrazide |
| IUPAC Name | N'-benzoylbenzohydrazide |
| InChI Key | GRRIYLZJLGTQJX-UHFFFAOYSA-N |
| Molecular Formula | C14H12N2O2 |
tert-Butyl Diethylphosphonoacetate 97.0+%, TCI America™
CAS: 27784-76-5 Molecular Formula: C10H21O5P Molecular Weight (g/mol): 252.247 InChI Key: NFEGNISFSSLEGU-UHFFFAOYSA-N Synonym: tert-butyl diethylphosphonoacetate,tert-butyl 2-diethoxyphosphoryl acetate,diethyl boc-methyl phosphonate,diethoxy-phosphoryl-acetic acid tert-butyl ester,t-butyl diethylphosphonoacetate,diethyl phosphonoacetic acid tert-butyl ester,t-butyl diethyl phosphonoacetate,diethylphosphonoacetic acid tert-butyl ester,diethyl 2-tert-butoxycarbonylmethyl phosphonate,acetic acid, diethoxyphosphinyl-, 1,1-dimethylethyl ester PubChem CID: 2773685 IUPAC Name: tert-butyl 2-diethoxyphosphorylacetate SMILES: CCOP(=O)(CC(=O)OC(C)(C)C)OCC
| PubChem CID | 2773685 |
|---|---|
| CAS | 27784-76-5 |
| Molecular Weight (g/mol) | 252.247 |
| SMILES | CCOP(=O)(CC(=O)OC(C)(C)C)OCC |
| Synonym | tert-butyl diethylphosphonoacetate,tert-butyl 2-diethoxyphosphoryl acetate,diethyl boc-methyl phosphonate,diethoxy-phosphoryl-acetic acid tert-butyl ester,t-butyl diethylphosphonoacetate,diethyl phosphonoacetic acid tert-butyl ester,t-butyl diethyl phosphonoacetate,diethylphosphonoacetic acid tert-butyl ester,diethyl 2-tert-butoxycarbonylmethyl phosphonate,acetic acid, diethoxyphosphinyl-, 1,1-dimethylethyl ester |
| IUPAC Name | tert-butyl 2-diethoxyphosphorylacetate |
| InChI Key | NFEGNISFSSLEGU-UHFFFAOYSA-N |
| Molecular Formula | C10H21O5P |
Methyl 4-Chloro-2-methylbutyrate 98.0+%, TCI America™
CAS: 13888-03-4 Molecular Formula: C6H11ClO2 Molecular Weight (g/mol): 150.602 MDL Number: MFCD00198001 InChI Key: ZDDYJHVTUSUPFC-UHFFFAOYSA-N Synonym: 4-Chloro-2-methylbutyric Acid Methyl Ester PubChem CID: 11263584 IUPAC Name: methyl 4-chloro-2-methylbutanoate SMILES: CC(CCCl)C(=O)OC
| PubChem CID | 11263584 |
|---|---|
| CAS | 13888-03-4 |
| Molecular Weight (g/mol) | 150.602 |
| MDL Number | MFCD00198001 |
| SMILES | CC(CCCl)C(=O)OC |
| Synonym | 4-Chloro-2-methylbutyric Acid Methyl Ester |
| IUPAC Name | methyl 4-chloro-2-methylbutanoate |
| InChI Key | ZDDYJHVTUSUPFC-UHFFFAOYSA-N |
| Molecular Formula | C6H11ClO2 |
Sodium 1-Butanesulfonate 98.0+%, TCI America™
CAS: 2386-54-1 Molecular Formula: C4H9NaO3S Molecular Weight (g/mol): 160.16 MDL Number: MFCD00007540 InChI Key: XQCHMGAOAWZUPI-UHFFFAOYSA-M Synonym: sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot PubChem CID: 4096517 IUPAC Name: sodium butane-1-sulfonate SMILES: [Na+].CCCCS([O-])(=O)=O
| PubChem CID | 4096517 |
|---|---|
| CAS | 2386-54-1 |
| Molecular Weight (g/mol) | 160.16 |
| MDL Number | MFCD00007540 |
| SMILES | [Na+].CCCCS([O-])(=O)=O |
| Synonym | sodium 1-butanesulfonate,sodium butane-1-sulfonate,1-butanesulfonic acid sodium salt,sodium butylsulfonate,1-butanesulfonic acid, sodium salt,sodium butane-1-sulphonate,sodium butanesulfonate,ipc-alks-4,1-butanesulfonic acid, sodium salt 1:1,acmc-1cdot |
| IUPAC Name | sodium butane-1-sulfonate |
| InChI Key | XQCHMGAOAWZUPI-UHFFFAOYSA-M |
| Molecular Formula | C4H9NaO3S |
Ethyl trans-4-Decenoate 98.0+%, TCI America™
CAS: 76649-16-6 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.31 MDL Number: MFCD00015574 InChI Key: AWNIQMQADACLCJ-CMDGGOBGSA-N Synonym: ethyl trans-4-decenoate,ethyl e-4-decenoate,ethyl 4-decenoate,4-decenoic acid, ethyl ester, e,ethyl 4e-decenoate,fema no. 3642,ethyl 4e-dec-4-enoate,ethyl trans-dec-4-enoate,ethyl e-dec-4-enoate,ethyl 4e-4-decenoate PubChem CID: 5362583 IUPAC Name: ethyl (4E)-dec-4-enoate SMILES: CCCCC\C=C\CCC(=O)OCC
| PubChem CID | 5362583 |
|---|---|
| CAS | 76649-16-6 |
| Molecular Weight (g/mol) | 198.31 |
| MDL Number | MFCD00015574 |
| SMILES | CCCCC\C=C\CCC(=O)OCC |
| Synonym | ethyl trans-4-decenoate,ethyl e-4-decenoate,ethyl 4-decenoate,4-decenoic acid, ethyl ester, e,ethyl 4e-decenoate,fema no. 3642,ethyl 4e-dec-4-enoate,ethyl trans-dec-4-enoate,ethyl e-dec-4-enoate,ethyl 4e-4-decenoate |
| IUPAC Name | ethyl (4E)-dec-4-enoate |
| InChI Key | AWNIQMQADACLCJ-CMDGGOBGSA-N |
| Molecular Formula | C12H22O2 |
Pretilachlor 97.0+%, TCI America™
CAS: 51218-49-6 Molecular Formula: C17H26ClNO2 Molecular Weight (g/mol): 311.85 MDL Number: MFCD00161476 InChI Key: YLPGTOIOYRQOHV-UHFFFAOYSA-N Synonym: pretilachlor,solnet,2-chloro-n-2,6-diethylphenyl-n-2-propoxyethyl acetamide,rifit,pretilachlore,pretilachlor bsi:iso,pretilachlore iso-french,2-chloro-2',6'-diethyl-n-2-propoxyethyl acetanilide,unii-617k7lm10d,n-propoxyethyl-n-chloroacetyl-2,6-diethylaniline PubChem CID: 91644 ChEBI: CHEBI:34931 IUPAC Name: 2-chloro-N-(2,6-diethylphenyl)-N-(2-propoxyethyl)acetamide SMILES: CCCOCCN(C1=C(C=CC=C1CC)CC)C(=O)CCl
| PubChem CID | 91644 |
|---|---|
| CAS | 51218-49-6 |
| Molecular Weight (g/mol) | 311.85 |
| ChEBI | CHEBI:34931 |
| MDL Number | MFCD00161476 |
| SMILES | CCCOCCN(C1=C(C=CC=C1CC)CC)C(=O)CCl |
| Synonym | pretilachlor,solnet,2-chloro-n-2,6-diethylphenyl-n-2-propoxyethyl acetamide,rifit,pretilachlore,pretilachlor bsi:iso,pretilachlore iso-french,2-chloro-2',6'-diethyl-n-2-propoxyethyl acetanilide,unii-617k7lm10d,n-propoxyethyl-n-chloroacetyl-2,6-diethylaniline |
| IUPAC Name | 2-chloro-N-(2,6-diethylphenyl)-N-(2-propoxyethyl)acetamide |
| InChI Key | YLPGTOIOYRQOHV-UHFFFAOYSA-N |
| Molecular Formula | C17H26ClNO2 |
tert-Butyl Propionate 98.0+%, TCI America™
CAS: 20487-40-5 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.19 MDL Number: MFCD00009304 InChI Key: JAELLLITIZHOGQ-UHFFFAOYSA-N Synonym: tert-butyl propionate,propanoic acid, 1,1-dimethylethyl ester,propionic acid, tert-butyl ester,t-butyl propionate,t-butyl propanoate,tert-butylpropionate,1,1-dimethylethyl propionate,tert-?butyl propionate,propionic acid tert-butyl ester,acmc-1cr5r PubChem CID: 88561 IUPAC Name: tert-butyl propanoate SMILES: CCC(=O)OC(C)(C)C
| PubChem CID | 88561 |
|---|---|
| CAS | 20487-40-5 |
| Molecular Weight (g/mol) | 130.19 |
| MDL Number | MFCD00009304 |
| SMILES | CCC(=O)OC(C)(C)C |
| Synonym | tert-butyl propionate,propanoic acid, 1,1-dimethylethyl ester,propionic acid, tert-butyl ester,t-butyl propionate,t-butyl propanoate,tert-butylpropionate,1,1-dimethylethyl propionate,tert-?butyl propionate,propionic acid tert-butyl ester,acmc-1cr5r |
| IUPAC Name | tert-butyl propanoate |
| InChI Key | JAELLLITIZHOGQ-UHFFFAOYSA-N |
| Molecular Formula | C7H14O2 |
Isobutyl Hexanoate 98.0+%, TCI America™
CAS: 105-79-3 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.268 MDL Number: MFCD00048870 InChI Key: UXUPPWPIGVTVQI-UHFFFAOYSA-N Synonym: isobutyl hexanoate,isobutyl caproate,hexanoic acid, 2-methylpropyl ester,hexanoic acid, isobutyl ester,2-methyl-1-propyl caproate,n-caproic acid isobutyl ester,isobutyl caproate natural,unii-2a3x4w9gz0,fema no. 2202,iso-butyl n-hexanoate PubChem CID: 7775 ChEBI: CHEBI:87421 IUPAC Name: 2-methylpropyl hexanoate SMILES: CCCCCC(=O)OCC(C)C
| PubChem CID | 7775 |
|---|---|
| CAS | 105-79-3 |
| Molecular Weight (g/mol) | 172.268 |
| ChEBI | CHEBI:87421 |
| MDL Number | MFCD00048870 |
| SMILES | CCCCCC(=O)OCC(C)C |
| Synonym | isobutyl hexanoate,isobutyl caproate,hexanoic acid, 2-methylpropyl ester,hexanoic acid, isobutyl ester,2-methyl-1-propyl caproate,n-caproic acid isobutyl ester,isobutyl caproate natural,unii-2a3x4w9gz0,fema no. 2202,iso-butyl n-hexanoate |
| IUPAC Name | 2-methylpropyl hexanoate |
| InChI Key | UXUPPWPIGVTVQI-UHFFFAOYSA-N |
| Molecular Formula | C10H20O2 |
4-Chloroaniline-3-sulfonic Acid 98.0+%, TCI America™
CAS: 88-43-7 Molecular Formula: C6H6ClNO3S Molecular Weight (g/mol): 207.628 MDL Number: MFCD00025296 InChI Key: VPXCXBHLKDPWQV-UHFFFAOYSA-N Synonym: 5-Amino-2-chlorobenzenesulfonic Acid PubChem CID: 6933 IUPAC Name: 5-amino-2-chlorobenzenesulfonic acid SMILES: C1=CC(=C(C=C1N)S(=O)(=O)O)Cl
| PubChem CID | 6933 |
|---|---|
| CAS | 88-43-7 |
| Molecular Weight (g/mol) | 207.628 |
| MDL Number | MFCD00025296 |
| SMILES | C1=CC(=C(C=C1N)S(=O)(=O)O)Cl |
| Synonym | 5-Amino-2-chlorobenzenesulfonic Acid |
| IUPAC Name | 5-amino-2-chlorobenzenesulfonic acid |
| InChI Key | VPXCXBHLKDPWQV-UHFFFAOYSA-N |
| Molecular Formula | C6H6ClNO3S |
Ethyl Chloroacetate 98.0+%, TCI America™
CAS: 105-39-5 Molecular Formula: C4H7ClO2 Molecular Weight (g/mol): 122.548 MDL Number: MFCD00000932 InChI Key: VEUUMBGHMNQHGO-UHFFFAOYSA-N Synonym: ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf PubChem CID: 7751 IUPAC Name: ethyl 2-chloroacetate SMILES: CCOC(=O)CCl
| PubChem CID | 7751 |
|---|---|
| CAS | 105-39-5 |
| Molecular Weight (g/mol) | 122.548 |
| MDL Number | MFCD00000932 |
| SMILES | CCOC(=O)CCl |
| Synonym | ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf |
| IUPAC Name | ethyl 2-chloroacetate |
| InChI Key | VEUUMBGHMNQHGO-UHFFFAOYSA-N |
| Molecular Formula | C4H7ClO2 |
3-Bromopropionamide 98.0+%, TCI America™
CAS: 6320-96-3 Molecular Formula: C3H6BrNO Molecular Weight (g/mol): 151.991 MDL Number: MFCD00143100 InChI Key: DBIVLAVBOICUQX-UHFFFAOYSA-N PubChem CID: 233589 IUPAC Name: 3-bromopropanamide SMILES: C(CBr)C(=O)N
| PubChem CID | 233589 |
|---|---|
| CAS | 6320-96-3 |
| Molecular Weight (g/mol) | 151.991 |
| MDL Number | MFCD00143100 |
| SMILES | C(CBr)C(=O)N |
| IUPAC Name | 3-bromopropanamide |
| InChI Key | DBIVLAVBOICUQX-UHFFFAOYSA-N |
| Molecular Formula | C3H6BrNO |
N-Chloromethylphthalimide 98.0+%, TCI America™
CAS: 17564-64-6 Molecular Formula: C9H6ClNO2 Molecular Weight (g/mol): 195.602 MDL Number: MFCD00005898 InChI Key: JKGLRGGCGUQNEX-UHFFFAOYSA-N Synonym: n-chloromethyl phthalimide,2-chloromethyl isoindoline-1,3-dione,n-chloromethylphthalimide,chloromethylphthalimide,n-chloromethyltrimellitimide,1h-isoindole-1,3 2h-dione, 2-chloromethyl,phthalimide, n-chloromethyl,2-chloromethyl isoindole-1,3-dione,2-chloromethyl-1h-isoindole-1,3 2h-dione PubChem CID: 87154 IUPAC Name: 2-(chloromethyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCl
| PubChem CID | 87154 |
|---|---|
| CAS | 17564-64-6 |
| Molecular Weight (g/mol) | 195.602 |
| MDL Number | MFCD00005898 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCl |
| Synonym | n-chloromethyl phthalimide,2-chloromethyl isoindoline-1,3-dione,n-chloromethylphthalimide,chloromethylphthalimide,n-chloromethyltrimellitimide,1h-isoindole-1,3 2h-dione, 2-chloromethyl,phthalimide, n-chloromethyl,2-chloromethyl isoindole-1,3-dione,2-chloromethyl-1h-isoindole-1,3 2h-dione |
| IUPAC Name | 2-(chloromethyl)isoindole-1,3-dione |
| InChI Key | JKGLRGGCGUQNEX-UHFFFAOYSA-N |
| Molecular Formula | C9H6ClNO2 |
N-(5-Bromopentyl)phthalimide 98.0+%, TCI America™
CAS: 954-81-4 Molecular Formula: C13H14BrNO2 Molecular Weight (g/mol): 296.164 MDL Number: MFCD00060522 InChI Key: QKVHAKICMNABGB-UHFFFAOYSA-N Synonym: n-5-bromopentyl phthalimide,2-5-bromopentyl isoindole-1,3-dione,n-5-bromopentyl-phthalimide,2-5-bromopentyl isoindoline-1,3-dione,2-5-bromo-pentyl-isoindole-1,3-dione,2-5-bromopentyl-1h-isoindole-1,3 2h-dione,2-5-bromopentyl-2,3-dihydro-1h-isoindole-1,3-dione,5-phthalimidopentyl bromide,1-bromo-5-phthalimidopentane PubChem CID: 136770 IUPAC Name: 2-(5-bromopentyl)isoindole-1,3-dione SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCBr
| PubChem CID | 136770 |
|---|---|
| CAS | 954-81-4 |
| Molecular Weight (g/mol) | 296.164 |
| MDL Number | MFCD00060522 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCBr |
| Synonym | n-5-bromopentyl phthalimide,2-5-bromopentyl isoindole-1,3-dione,n-5-bromopentyl-phthalimide,2-5-bromopentyl isoindoline-1,3-dione,2-5-bromo-pentyl-isoindole-1,3-dione,2-5-bromopentyl-1h-isoindole-1,3 2h-dione,2-5-bromopentyl-2,3-dihydro-1h-isoindole-1,3-dione,5-phthalimidopentyl bromide,1-bromo-5-phthalimidopentane |
| IUPAC Name | 2-(5-bromopentyl)isoindole-1,3-dione |
| InChI Key | QKVHAKICMNABGB-UHFFFAOYSA-N |
| Molecular Formula | C13H14BrNO2 |