Organic acids and derivatives
Filtered Search Results
trans-Aconitic Acid 98.0+%, TCI America™
CAS: 4023-65-8 Molecular Formula: C6H6O6 Molecular Weight (g/mol): 174.108 MDL Number: MFCD00002721 InChI Key: GTZCVFVGUGFEME-HNQUOIGGSA-N Synonym: trans-aconitic acid,trans-aconitate,e-1-propene-1,2,3-tricarboxylic acid,aconitic acid,e-prop-1-ene-1,2,3-tricarboxylic acid,aconitic acid, trans,trans aconitic acid,e-aconitic acid,unii-7db37960cw,1e-1-propene-1,2,3-tricarboxylic acid PubChem CID: 444212 ChEBI: CHEBI:32806 IUPAC Name: (E)-prop-1-ene-1,2,3-tricarboxylic acid SMILES: C(C(=CC(=O)O)C(=O)O)C(=O)O
| PubChem CID | 444212 |
|---|---|
| CAS | 4023-65-8 |
| Molecular Weight (g/mol) | 174.108 |
| ChEBI | CHEBI:32806 |
| MDL Number | MFCD00002721 |
| SMILES | C(C(=CC(=O)O)C(=O)O)C(=O)O |
| Synonym | trans-aconitic acid,trans-aconitate,e-1-propene-1,2,3-tricarboxylic acid,aconitic acid,e-prop-1-ene-1,2,3-tricarboxylic acid,aconitic acid, trans,trans aconitic acid,e-aconitic acid,unii-7db37960cw,1e-1-propene-1,2,3-tricarboxylic acid |
| IUPAC Name | (E)-prop-1-ene-1,2,3-tricarboxylic acid |
| InChI Key | GTZCVFVGUGFEME-HNQUOIGGSA-N |
| Molecular Formula | C6H6O6 |
1-Acetyl-3-methylurea 98.0+%, TCI America™
CAS: 623-59-6 Molecular Formula: C4H8N2O2 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00026167 InChI Key: XRVHSOXXNQTWAW-UHFFFAOYSA-N PubChem CID: 69337 IUPAC Name: N-(methylcarbamoyl)acetamide SMILES: CC(=O)NC(=O)NC
| PubChem CID | 69337 |
|---|---|
| CAS | 623-59-6 |
| Molecular Weight (g/mol) | 116.12 |
| MDL Number | MFCD00026167 |
| SMILES | CC(=O)NC(=O)NC |
| IUPAC Name | N-(methylcarbamoyl)acetamide |
| InChI Key | XRVHSOXXNQTWAW-UHFFFAOYSA-N |
| Molecular Formula | C4H8N2O2 |
3-Phenylpropyl Acetate 98.0+%, TCI America™
CAS: 122-72-5 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00026216 InChI Key: JRJGKUTZNBZHNK-UHFFFAOYSA-N Synonym: hydrocinnamyl acetate,benzenepropanol, acetate,phenylpropyl acetate,3-phenyl-1-propyl acetate,3-acetoxypropyl benzene,3-phenyl-1-propanol, acetate,3-acetoxy-1-phenylpropane,1-acetoxy-3-phenylpropane,benzenepropanol, 1-acetate,benzenepropyl acetate PubChem CID: 31226 ChEBI: CHEBI:81257 IUPAC Name: 3-phenylpropyl acetate SMILES: CC(=O)OCCCC1=CC=CC=C1
| PubChem CID | 31226 |
|---|---|
| CAS | 122-72-5 |
| Molecular Weight (g/mol) | 178.231 |
| ChEBI | CHEBI:81257 |
| MDL Number | MFCD00026216 |
| SMILES | CC(=O)OCCCC1=CC=CC=C1 |
| Synonym | hydrocinnamyl acetate,benzenepropanol, acetate,phenylpropyl acetate,3-phenyl-1-propyl acetate,3-acetoxypropyl benzene,3-phenyl-1-propanol, acetate,3-acetoxy-1-phenylpropane,1-acetoxy-3-phenylpropane,benzenepropanol, 1-acetate,benzenepropyl acetate |
| IUPAC Name | 3-phenylpropyl acetate |
| InChI Key | JRJGKUTZNBZHNK-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
7-Deazahypoxanthine 98.0+%, TCI America™
CAS: 3680-71-5 Molecular Formula: C6H5N3O Molecular Weight (g/mol): 135.13 MDL Number: MFCD08445809 InChI Key: FBMZEITWVNHWJW-UHFFFAOYSA-N Synonym: 7h-pyrrolo 2,3-d pyrimidin-4-ol,pyrrolo 2,3-d pyrimidin-4-ol,7-deazahypoxanthine,3h-pyrrolo 2,3-d pyrimidin-4 7h-one,4-hydroxypyrrolo 2,3-d pyrimidine,4-hydroxypyrrolopyrimidine,1h-pyrrolo 2,3-d pyrimidin-4 7h-one,3,7-dihydro-4h-pyrrolo 2,3-d pyrimidin-4-one,pyrrolo 2,3-d pyrimidin-4-one PubChem CID: 96194 IUPAC Name: 1H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one SMILES: O=C1N=CNC2=C1C=CN2
| PubChem CID | 96194 |
|---|---|
| CAS | 3680-71-5 |
| Molecular Weight (g/mol) | 135.13 |
| MDL Number | MFCD08445809 |
| SMILES | O=C1N=CNC2=C1C=CN2 |
| Synonym | 7h-pyrrolo 2,3-d pyrimidin-4-ol,pyrrolo 2,3-d pyrimidin-4-ol,7-deazahypoxanthine,3h-pyrrolo 2,3-d pyrimidin-4 7h-one,4-hydroxypyrrolo 2,3-d pyrimidine,4-hydroxypyrrolopyrimidine,1h-pyrrolo 2,3-d pyrimidin-4 7h-one,3,7-dihydro-4h-pyrrolo 2,3-d pyrimidin-4-one,pyrrolo 2,3-d pyrimidin-4-one |
| IUPAC Name | 1H,4H,7H-pyrrolo[2,3-d]pyrimidin-4-one |
| InChI Key | FBMZEITWVNHWJW-UHFFFAOYSA-N |
| Molecular Formula | C6H5N3O |
3,5-Dimethoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 192182-54-0 Molecular Formula: C8H11BO4 Molecular Weight (g/mol): 181.982 MDL Number: MFCD03095127 InChI Key: XUIURRYWQBBCCK-UHFFFAOYSA-N PubChem CID: 4374257 IUPAC Name: (3,5-dimethoxyphenyl)boronic acid SMILES: B(C1=CC(=CC(=C1)OC)OC)(O)O
| PubChem CID | 4374257 |
|---|---|
| CAS | 192182-54-0 |
| Molecular Weight (g/mol) | 181.982 |
| MDL Number | MFCD03095127 |
| SMILES | B(C1=CC(=CC(=C1)OC)OC)(O)O |
| IUPAC Name | (3,5-dimethoxyphenyl)boronic acid |
| InChI Key | XUIURRYWQBBCCK-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO4 |
2,6-Dimethoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 23112-96-1 Molecular Formula: C8H11BO4 MDL Number: MFCD01318987 InChI Key: BKWVXPCYDRURMK-UHFFFAOYSA-N PubChem CID: 2734343 IUPAC Name: (2,6-dimethoxyphenyl)boronic acid
| PubChem CID | 2734343 |
|---|---|
| CAS | 23112-96-1 |
| MDL Number | MFCD01318987 |
| IUPAC Name | (2,6-dimethoxyphenyl)boronic acid |
| InChI Key | BKWVXPCYDRURMK-UHFFFAOYSA-N |
| Molecular Formula | C8H11BO4 |
sec-Butyl Acetate 98.0+%, TCI America™
CAS: 105-46-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009328 InChI Key: DCKVNWZUADLDEH-UHFFFAOYNA-N Synonym: sec-butyl acetate,dl-sec-butyl acetate,2-butyl acetate,acetic acid, 1-methylpropyl ester,1-methylpropyl acetate,sec-butyl ethanoate,1-methylpropyl ethanoate,acetic acid, sec-butyl ester,2-butanol acetate,sec-butyl alcohol acetate PubChem CID: 7758 IUPAC Name: butan-2-yl acetate SMILES: CCC(C)OC(C)=O
| PubChem CID | 7758 |
|---|---|
| CAS | 105-46-4 |
| Molecular Weight (g/mol) | 116.16 |
| MDL Number | MFCD00009328 |
| SMILES | CCC(C)OC(C)=O |
| Synonym | sec-butyl acetate,dl-sec-butyl acetate,2-butyl acetate,acetic acid, 1-methylpropyl ester,1-methylpropyl acetate,sec-butyl ethanoate,1-methylpropyl ethanoate,acetic acid, sec-butyl ester,2-butanol acetate,sec-butyl alcohol acetate |
| IUPAC Name | butan-2-yl acetate |
| InChI Key | DCKVNWZUADLDEH-UHFFFAOYNA-N |
| Molecular Formula | C6H12O2 |
2,6-Difluoro-4-methoxyphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
CAS: 406482-20-0 Molecular Formula: C7H7BF2O3 Molecular Weight (g/mol): 187.94 MDL Number: MFCD05664299 InChI Key: WVSZSFADEBGONQ-UHFFFAOYSA-N Synonym: 2,6-Difluoro-4-methoxybenzeneboronic Acid PubChem CID: 16217424 IUPAC Name: (2,6-difluoro-4-methoxyphenyl)boronic acid SMILES: COC1=CC(F)=C(B(O)O)C(F)=C1
| PubChem CID | 16217424 |
|---|---|
| CAS | 406482-20-0 |
| Molecular Weight (g/mol) | 187.94 |
| MDL Number | MFCD05664299 |
| SMILES | COC1=CC(F)=C(B(O)O)C(F)=C1 |
| Synonym | 2,6-Difluoro-4-methoxybenzeneboronic Acid |
| IUPAC Name | (2,6-difluoro-4-methoxyphenyl)boronic acid |
| InChI Key | WVSZSFADEBGONQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7BF2O3 |
Benzyl 2,2,2-Trifluoro-N-phenylacetimidate 98.0+%, TCI America™
CAS: 952057-61-3 Molecular Formula: C15H12F3NO Molecular Weight (g/mol): 279.262 InChI Key: KVGZVQNJUZHPJJ-UHFFFAOYSA-N Synonym: 2,2,2-Trifluoro-N-phenylacetimidic Acid Benzyl Ester PubChem CID: 23583338 IUPAC Name: benzyl 2,2,2-trifluoro-N-phenylethanimidate SMILES: C1=CC=C(C=C1)COC(=NC2=CC=CC=C2)C(F)(F)F
| PubChem CID | 23583338 |
|---|---|
| CAS | 952057-61-3 |
| Molecular Weight (g/mol) | 279.262 |
| SMILES | C1=CC=C(C=C1)COC(=NC2=CC=CC=C2)C(F)(F)F |
| Synonym | 2,2,2-Trifluoro-N-phenylacetimidic Acid Benzyl Ester |
| IUPAC Name | benzyl 2,2,2-trifluoro-N-phenylethanimidate |
| InChI Key | KVGZVQNJUZHPJJ-UHFFFAOYSA-N |
| Molecular Formula | C15H12F3NO |
1-(2-Bromoisovaleryl)urea 98.0+%, TCI America™
CAS: 496-67-3 Molecular Formula: C6H11BrN2O2 Molecular Weight (g/mol): 223.07 InChI Key: CMCCHHWTTBEZNM-UHFFFAOYSA-N Synonym: bromisoval,bromisovalum,bromovalerylurea,bromvalerylurea,bromural,bromcarbamide,bromizoval,bromocarbamide,bromaral,bromisovalerylurea PubChem CID: 2447 ChEBI: CHEBI:77043 IUPAC Name: 2-bromo-N-carbamoyl-3-methylbutanamide SMILES: CC(C)C(C(=O)NC(=O)N)Br
| PubChem CID | 2447 |
|---|---|
| CAS | 496-67-3 |
| Molecular Weight (g/mol) | 223.07 |
| ChEBI | CHEBI:77043 |
| SMILES | CC(C)C(C(=O)NC(=O)N)Br |
| Synonym | bromisoval,bromisovalum,bromovalerylurea,bromvalerylurea,bromural,bromcarbamide,bromizoval,bromocarbamide,bromaral,bromisovalerylurea |
| IUPAC Name | 2-bromo-N-carbamoyl-3-methylbutanamide |
| InChI Key | CMCCHHWTTBEZNM-UHFFFAOYSA-N |
| Molecular Formula | C6H11BrN2O2 |
Methyl Benzimidate Hydrochloride 98.0+%, TCI America™
CAS: 5873-90-5 Molecular Formula: C8H10ClNO Molecular Weight (g/mol): 171.624 MDL Number: MFCD00012575 InChI Key: HDJNHVNQRJMWSH-UHFFFAOYSA-N Synonym: methyl benzimidate hydrochloride,methyl benzimidate hcl,methyl benzenecarboximidoate hydrochloride,benzimidic acid methyl ester hydrochloride,methyl benzenecarboximidate hydrochloride,benzenecarboximidic acid methyl ester hydrochloride,benzinidic acid methyl ester hydrochloride,benzenecarboximidic acid, methyl ester, hydrochloride,methoxyphenylmethanimine, chloride,acmc-1axhh PubChem CID: 5743287 IUPAC Name: methyl benzenecarboximidate;hydrochloride SMILES: COC(=N)C1=CC=CC=C1.Cl
| PubChem CID | 5743287 |
|---|---|
| CAS | 5873-90-5 |
| Molecular Weight (g/mol) | 171.624 |
| MDL Number | MFCD00012575 |
| SMILES | COC(=N)C1=CC=CC=C1.Cl |
| Synonym | methyl benzimidate hydrochloride,methyl benzimidate hcl,methyl benzenecarboximidoate hydrochloride,benzimidic acid methyl ester hydrochloride,methyl benzenecarboximidate hydrochloride,benzenecarboximidic acid methyl ester hydrochloride,benzinidic acid methyl ester hydrochloride,benzenecarboximidic acid, methyl ester, hydrochloride,methoxyphenylmethanimine, chloride,acmc-1axhh |
| IUPAC Name | methyl benzenecarboximidate;hydrochloride |
| InChI Key | HDJNHVNQRJMWSH-UHFFFAOYSA-N |
| Molecular Formula | C8H10ClNO |
Ethyl Carbamate 98.0+%, TCI America™
CAS: 51-79-6 Molecular Formula: C3H7NO2 Molecular Weight (g/mol): 89.094 MDL Number: MFCD00007966 InChI Key: JOYRKODLDBILNP-UHFFFAOYSA-N Synonym: urethane,urethan,ethylurethane,carbamic acid ethyl ester,ethyl urethane,carbamic acid, ethyl ester,ethylcarbamate,pracarbamine,leucethane,pracarbamin PubChem CID: 5641 ChEBI: CHEBI:17967 IUPAC Name: ethyl carbamate SMILES: CCOC(=O)N
| PubChem CID | 5641 |
|---|---|
| CAS | 51-79-6 |
| Molecular Weight (g/mol) | 89.094 |
| ChEBI | CHEBI:17967 |
| MDL Number | MFCD00007966 |
| SMILES | CCOC(=O)N |
| Synonym | urethane,urethan,ethylurethane,carbamic acid ethyl ester,ethyl urethane,carbamic acid, ethyl ester,ethylcarbamate,pracarbamine,leucethane,pracarbamin |
| IUPAC Name | ethyl carbamate |
| InChI Key | JOYRKODLDBILNP-UHFFFAOYSA-N |
| Molecular Formula | C3H7NO2 |
Benzoylurea 98.0+%, TCI America™
CAS: 614-22-2 Molecular Formula: C8H8N2O2 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00025441 InChI Key: HRYILSDLIGTCOP-UHFFFAOYSA-N Synonym: benzoylurea,1-benzoylurea,n-benzoylurea,urea, benzoyl,benzoic acid, ureide,n-aminocarbonyl benzamide,benzamide, n-aminocarbonyl,benzamide, n-aminocarbonyl-9ci,benzoyl urea,benzoylcarbamide PubChem CID: 69190 ChEBI: CHEBI:39416 IUPAC Name: benzoylurea SMILES: NC(=O)NC(=O)C1=CC=CC=C1
| PubChem CID | 69190 |
|---|---|
| CAS | 614-22-2 |
| Molecular Weight (g/mol) | 164.16 |
| ChEBI | CHEBI:39416 |
| MDL Number | MFCD00025441 |
| SMILES | NC(=O)NC(=O)C1=CC=CC=C1 |
| Synonym | benzoylurea,1-benzoylurea,n-benzoylurea,urea, benzoyl,benzoic acid, ureide,n-aminocarbonyl benzamide,benzamide, n-aminocarbonyl,benzamide, n-aminocarbonyl-9ci,benzoyl urea,benzoylcarbamide |
| IUPAC Name | benzoylurea |
| InChI Key | HRYILSDLIGTCOP-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2O2 |
1,3-Diallylurea 98.0+%, TCI America™
CAS: 1801-72-5 Molecular Formula: C7H12N2O Molecular Weight (g/mol): 140.186 MDL Number: MFCD00008639 InChI Key: QRWVOJLTHSRPOA-UHFFFAOYSA-N Synonym: 1,3-diallylurea,n,n'-diallylurea,urea, n,n'-di-2-propenyl,urea, 1,3-diallyl,unii-lxm0xy469i,diallyl urea,lxm0xy469i,urea,n,n'-di-2-propen-1-yl,diallylurea,sinapoline PubChem CID: 74537 IUPAC Name: 1,3-bis(prop-2-enyl)urea SMILES: C=CCNC(=O)NCC=C
| PubChem CID | 74537 |
|---|---|
| CAS | 1801-72-5 |
| Molecular Weight (g/mol) | 140.186 |
| MDL Number | MFCD00008639 |
| SMILES | C=CCNC(=O)NCC=C |
| Synonym | 1,3-diallylurea,n,n'-diallylurea,urea, n,n'-di-2-propenyl,urea, 1,3-diallyl,unii-lxm0xy469i,diallyl urea,lxm0xy469i,urea,n,n'-di-2-propen-1-yl,diallylurea,sinapoline |
| IUPAC Name | 1,3-bis(prop-2-enyl)urea |
| InChI Key | QRWVOJLTHSRPOA-UHFFFAOYSA-N |
| Molecular Formula | C7H12N2O |
Sodium Dodecyl Sulfate 97.0+%, TCI America™
CAS: 151-21-3 Molecular Formula: C12H25NaO4S Molecular Weight (g/mol): 288.38 MDL Number: MFCD00036175 InChI Key: DBMJMQXJHONAFJ-UHFFFAOYSA-M Synonym: sodium dodecyl sulfate,sodium lauryl sulfate,sodium dodecylsulfate,sodium lauryl sulphate,sodium dodecyl sulphate,dodecyl sulfate, sodium salt,anticerumen,gardinol,neutrazyme,duponal PubChem CID: 3423265 ChEBI: CHEBI:8984 IUPAC Name: sodium dodecyl sulfate SMILES: [Na+].CCCCCCCCCCCCOS([O-])(=O)=O
| PubChem CID | 3423265 |
|---|---|
| CAS | 151-21-3 |
| Molecular Weight (g/mol) | 288.38 |
| ChEBI | CHEBI:8984 |
| MDL Number | MFCD00036175 |
| SMILES | [Na+].CCCCCCCCCCCCOS([O-])(=O)=O |
| Synonym | sodium dodecyl sulfate,sodium lauryl sulfate,sodium dodecylsulfate,sodium lauryl sulphate,sodium dodecyl sulphate,dodecyl sulfate, sodium salt,anticerumen,gardinol,neutrazyme,duponal |
| IUPAC Name | sodium dodecyl sulfate |
| InChI Key | DBMJMQXJHONAFJ-UHFFFAOYSA-M |
| Molecular Formula | C12H25NaO4S |