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3-Amino-3-(3,4-dimethoxyphenyl)propionic acid - >98.0%(HPLC)(T), high purity , CAS No.34841-09-3

COA

Grade & Purity:

≥98%(HPLC)(T)

Cas Number: 34841-09-3
Molecular Weight: 225.24
MDL number: MFCD00735172
PubChem CID: 597182
PubChem SID: 488190593

In stock

Item Number

A138705

Grouped product items
SKU	Size	Availability	Price
A138705-1g	1g	5	$33.90
A138705-5g	5g	3	$166.90
A138705-25g	25g	3	$748.90
A138705-100g	100g	1	$2,693.90

View related series

Carbonyl compound (2335) carboxylic acid (2098)

Basic Description

Synonyms	SR-01000509532-1 \| 3-amino-3-(3,4-dimethoxyphenyl) propanoic acid \| A822430 \| EN300-05376 \| 3-(3,4-Dimethoxyphenyl)-beta-alanine \| SCHEMBL2991798 \| Z56895737 \| AG-205/40088415 \| FT-0687322 \| FT-0630330 \| Oprea1_306666 \| 3-Amino-3-(3,4-dimethoxy-phenyl)-pr
Specifications & Purity	≥98%(HPLC)(T)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Beta amino acids and derivatives

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives
Direct Parent	Beta amino acids and derivatives
Alternative Parents	Phenylpropanoic acids Dimethoxybenzenes Phenoxy compounds Anisoles Aralkylamines Alkyl aryl ethers Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Beta amino acid or derivatives - 3-phenylpropanoic-acid - O-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Amino acid - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organooxygen compound - Hydrocarbon derivative - Primary amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488190593
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488190593
IUPAC Name	3-amino-3-(3,4-dimethoxyphenyl)propanoic acid
INCHI	InChI=1S/C11H15NO4/c1-15-9-4-3-7(5-10(9)16-2)8(12)6-11(13)14/h3-5,8H,6,12H2,1-2H3,(H,13,14)
InChIKey	FGCXSFRGPCUBPW-UHFFFAOYSA-N
Smiles	COC1=C(C=C(C=C1)C(CC(=O)O)N)OC
Isomeric SMILES	COC1=C(C=C(C=C1)C(CC(=O)O)N)OC
WGK Germany	3
Molecular Weight	225.24
Reaxy-Rn	2124810
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2124810&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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7 results found

Lot Number	Certificate Type	Date	Item
E2315413	Certificate of Analysis	Feb 11, 2025	A138705
E2315409	Certificate of Analysis	Feb 11, 2025	A138705
C2306636	Certificate of Analysis	Dec 06, 2024	A138705
C2222212	Certificate of Analysis	Jan 05, 2024	A138705
C2222168	Certificate of Analysis	Jan 05, 2024	A138705
C2222169	Certificate of Analysis	Jan 05, 2024	A138705
J1628080	Certificate of Analysis	May 07, 2022	A138705

Chemical and Physical Properties

Melt Point(°C)	223°C
Molecular Weight	225.240 g/mol
XLogP3	-2.400
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	225.1 Da
Monoisotopic Mass	225.1 Da
Topological Polar Surface Area	81.800 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	234.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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