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This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
4-Hydroxy-3-methoxycinnamic acid is a ubiquitous plant constituent primarily occurring in seeds and leaves. It arises from the metabolism of phenylalanine and tyrosine.
trans-Cinnamic acid occurs in plants, formed via deamination of L-phenylalanine in the presence of enzymatic catalyst, L-phenylalanine ammonia-lyase.
Pharmaceutical secondary standards for application in quality control. Provides pharma laboratories and manufacturers with a convenient, and cost-effective alternative to the preparation of in-house working standards.
MDL Number | MFCD00131611 |
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CAS: 26093-31-2 Molecular Formula: C10H9NO2 Molecular Weight (g/mol): 175.19 MDL Number: MFCD00006868 InChI Key: GLNDAGDHSLMOKX-UHFFFAOYSA-N Synonym: 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x PubChem CID: 92249 ChEBI: CHEBI:51771 IUPAC Name: 7-amino-4-methyl-2H-chromen-2-one SMILES: CC1=CC(=O)OC2=CC(N)=CC=C12
PubChem CID | 92249 |
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CAS | 26093-31-2 |
Molecular Weight (g/mol) | 175.19 |
ChEBI | CHEBI:51771 |
MDL Number | MFCD00006868 |
SMILES | CC1=CC(=O)OC2=CC(N)=CC=C12 |
Synonym | 7-amino-4-methylcoumarin,coumarin 120,7-amino-4-methyl-2h-chromen-2-one,2h-1-benzopyran-2-one, 7-amino-4-methyl,coumarin, 7-amino-4-methyl,4-methyl-7-aminocoumarin,7-amino-4-methyl-chromen-2-one,unii-ocy3jct44x,ccris 4961,ocy3jct44x |
IUPAC Name | 7-amino-4-methyl-2H-chromen-2-one |
InChI Key | GLNDAGDHSLMOKX-UHFFFAOYSA-N |
Molecular Formula | C10H9NO2 |
CAS: 161024-80-2 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.309 MDL Number: MFCD01320859 InChI Key: JTNQFJPZRTURSI-LLVKDONJSA-N Synonym: r-n-boc-3-amino-3-phenylpropanoic acid,r-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,boc-r-3-amino-3-phenylpropionic acid,boc-beta-phe-oh,r-3-boc-amino-3-phenylpropionic acid,r-3-boc-amino-3-phenylpropanoic acid,boc-r-phenylalanine,3r-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,r-3-tert-butoxycarbonylamino-3-phenyl-propionic acid PubChem CID: 7009108 IUPAC Name: (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1
PubChem CID | 7009108 |
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CAS | 161024-80-2 |
Molecular Weight (g/mol) | 265.309 |
MDL Number | MFCD01320859 |
SMILES | CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1 |
Synonym | r-n-boc-3-amino-3-phenylpropanoic acid,r-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,boc-r-3-amino-3-phenylpropionic acid,boc-beta-phe-oh,r-3-boc-amino-3-phenylpropionic acid,r-3-boc-amino-3-phenylpropanoic acid,boc-r-phenylalanine,3r-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,r-3-tert-butoxycarbonylamino-3-phenyl-propionic acid |
IUPAC Name | (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid |
InChI Key | JTNQFJPZRTURSI-LLVKDONJSA-N |
Molecular Formula | C14H19NO4 |
CAS: 881190-93-8 Molecular Formula: C9H8ClFO2 Molecular Weight (g/mol): 202.609 MDL Number: MFCD04116056 InChI Key: XJSXYOSRQKEOSZ-UHFFFAOYSA-N Synonym: 3-3-chloro-4-fluorophenyl propanoic acid,3-3-chloro-4-fluorophenyl propionic acid,3-chloro-4-fluorobenzenepropanoic acid,3-3-chloro-4-fluorophenyl propanoicacid,benzenepropanoicacid, 3-chloro-4-fluoro,3-3-chloro-4-fluoro-phenyl-propionic acid PubChem CID: 3503171 IUPAC Name: 3-(3-chloro-4-fluorophenyl)propanoic acid SMILES: C1=CC(=C(C=C1CCC(=O)O)Cl)F
PubChem CID | 3503171 |
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CAS | 881190-93-8 |
Molecular Weight (g/mol) | 202.609 |
MDL Number | MFCD04116056 |
SMILES | C1=CC(=C(C=C1CCC(=O)O)Cl)F |
Synonym | 3-3-chloro-4-fluorophenyl propanoic acid,3-3-chloro-4-fluorophenyl propionic acid,3-chloro-4-fluorobenzenepropanoic acid,3-3-chloro-4-fluorophenyl propanoicacid,benzenepropanoicacid, 3-chloro-4-fluoro,3-3-chloro-4-fluoro-phenyl-propionic acid |
IUPAC Name | 3-(3-chloro-4-fluorophenyl)propanoic acid |
InChI Key | XJSXYOSRQKEOSZ-UHFFFAOYSA-N |
Molecular Formula | C9H8ClFO2 |
CAS: 51656-68-9 Molecular Formula: C9H8Cl2O2 Molecular Weight (g/mol): 219.061 MDL Number: MFCD01310807 InChI Key: IDEOVPXKPDUXTP-UHFFFAOYSA-N PubChem CID: 2758192 IUPAC Name: 3-(2,6-dichlorophenyl)propanoic acid SMILES: C1=CC(=C(C(=C1)Cl)CCC(=O)O)Cl
PubChem CID | 2758192 |
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CAS | 51656-68-9 |
Molecular Weight (g/mol) | 219.061 |
MDL Number | MFCD01310807 |
SMILES | C1=CC(=C(C(=C1)Cl)CCC(=O)O)Cl |
IUPAC Name | 3-(2,6-dichlorophenyl)propanoic acid |
InChI Key | IDEOVPXKPDUXTP-UHFFFAOYSA-N |
Molecular Formula | C9H8Cl2O2 |
CAS: 82547-30-6 Molecular Formula: C10H11BrO3 Molecular Weight (g/mol): 259.10 MDL Number: MFCD09258907 InChI Key: RCLIOLQUIYTUPY-UHFFFAOYSA-N Synonym: 3-5-bromo-2-methoxyphenyl propanoic acid,benzenepropanoic acid, 5-bromo-2-methoxy,3-5-bromo-2-methoxyphenyl propionic acid,3-5-bromo-2-methoxy-phenyl-propionic acid PubChem CID: 22685184 IUPAC Name: 3-(5-bromo-2-methoxyphenyl)propanoic acid SMILES: COC1=C(CCC(O)=O)C=C(Br)C=C1
PubChem CID | 22685184 |
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CAS | 82547-30-6 |
Molecular Weight (g/mol) | 259.10 |
MDL Number | MFCD09258907 |
SMILES | COC1=C(CCC(O)=O)C=C(Br)C=C1 |
Synonym | 3-5-bromo-2-methoxyphenyl propanoic acid,benzenepropanoic acid, 5-bromo-2-methoxy,3-5-bromo-2-methoxyphenyl propionic acid,3-5-bromo-2-methoxy-phenyl-propionic acid |
IUPAC Name | 3-(5-bromo-2-methoxyphenyl)propanoic acid |
InChI Key | RCLIOLQUIYTUPY-UHFFFAOYSA-N |
Molecular Formula | C10H11BrO3 |
CAS: 1086386-05-1 Molecular Formula: C10H11ClO2 Molecular Weight (g/mol): 198.646 MDL Number: MFCD11655590 InChI Key: PCLIPGMIRVJYFB-UHFFFAOYSA-N Synonym: 3-4-chloro-3-methylphenyl propanoic acid,3-4-chloro-3-methyl-phenyl-propionic acid,3-4-chloro-3-methylphenyl propionic acid,benzenepropanoic acid, 4-chloro-3-methyl PubChem CID: 46741400 IUPAC Name: 3-(4-chloro-3-methylphenyl)propanoic acid SMILES: CC1=C(C=CC(=C1)CCC(=O)O)Cl
PubChem CID | 46741400 |
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CAS | 1086386-05-1 |
Molecular Weight (g/mol) | 198.646 |
MDL Number | MFCD11655590 |
SMILES | CC1=C(C=CC(=C1)CCC(=O)O)Cl |
Synonym | 3-4-chloro-3-methylphenyl propanoic acid,3-4-chloro-3-methyl-phenyl-propionic acid,3-4-chloro-3-methylphenyl propionic acid,benzenepropanoic acid, 4-chloro-3-methyl |
IUPAC Name | 3-(4-chloro-3-methylphenyl)propanoic acid |
InChI Key | PCLIPGMIRVJYFB-UHFFFAOYSA-N |
Molecular Formula | C10H11ClO2 |
CAS: 3243-40-1 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.257 MDL Number: MFCD00484121 InChI Key: SOFMLHAGBATXNZ-UHFFFAOYSA-N Synonym: 3-4-propoxyphenyl propanoic acid,3-4-propoxy-phenyl-propionic acid,benzenepropanoic acid,4-propoxy,3-4-n-propoxyphenyl propionic acid,cbmicro_011397,cambridge id 5152838,4-propoxy-benzenepropanoic acid,3-4-n-propoxyphenyl propanoic acid PubChem CID: 2255935 IUPAC Name: 3-(4-propoxyphenyl)propanoic acid SMILES: CCCOC1=CC=C(C=C1)CCC(=O)O
PubChem CID | 2255935 |
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CAS | 3243-40-1 |
Molecular Weight (g/mol) | 208.257 |
MDL Number | MFCD00484121 |
SMILES | CCCOC1=CC=C(C=C1)CCC(=O)O |
Synonym | 3-4-propoxyphenyl propanoic acid,3-4-propoxy-phenyl-propionic acid,benzenepropanoic acid,4-propoxy,3-4-n-propoxyphenyl propionic acid,cbmicro_011397,cambridge id 5152838,4-propoxy-benzenepropanoic acid,3-4-n-propoxyphenyl propanoic acid |
IUPAC Name | 3-(4-propoxyphenyl)propanoic acid |
InChI Key | SOFMLHAGBATXNZ-UHFFFAOYSA-N |
Molecular Formula | C12H16O3 |
CAS: 57668-34-5 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.301 MDL Number: MFCD09258905 InChI Key: HVXOYUOKPLHWNU-UHFFFAOYSA-N Synonym: 3-3-benzyloxy phenyl propanoic acid,benzenepropanoic acid, 3-phenylmethoxy,3-3-benzyloxy-phenyl-propanoic acid,3-3-benzyloxy phenyl propionic acid,3-3-phenylmethyl oxy phenyl propanoic acid PubChem CID: 21938504 IUPAC Name: 3-(3-phenylmethoxyphenyl)propanoic acid SMILES: C1=CC=C(C=C1)COC2=CC=CC(=C2)CCC(=O)O
PubChem CID | 21938504 |
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CAS | 57668-34-5 |
Molecular Weight (g/mol) | 256.301 |
MDL Number | MFCD09258905 |
SMILES | C1=CC=C(C=C1)COC2=CC=CC(=C2)CCC(=O)O |
Synonym | 3-3-benzyloxy phenyl propanoic acid,benzenepropanoic acid, 3-phenylmethoxy,3-3-benzyloxy-phenyl-propanoic acid,3-3-benzyloxy phenyl propionic acid,3-3-phenylmethyl oxy phenyl propanoic acid |
IUPAC Name | 3-(3-phenylmethoxyphenyl)propanoic acid |
InChI Key | HVXOYUOKPLHWNU-UHFFFAOYSA-N |
Molecular Formula | C16H16O3 |
CAS: 10538-49-5 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00060325 InChI Key: JENQUCZZZGYHRW-UHFFFAOYSA-N PubChem CID: 66343 IUPAC Name: 3-(2,5-dimethoxyphenyl)propanoic acid SMILES: COC1=CC=C(OC)C(CCC(O)=O)=C1
PubChem CID | 66343 |
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CAS | 10538-49-5 |
Molecular Weight (g/mol) | 210.23 |
MDL Number | MFCD00060325 |
SMILES | COC1=CC=C(OC)C(CCC(O)=O)=C1 |
IUPAC Name | 3-(2,5-dimethoxyphenyl)propanoic acid |
InChI Key | JENQUCZZZGYHRW-UHFFFAOYSA-N |
Molecular Formula | C11H14O4 |