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L-3-Cyanophenylalanine - 98%, high purity , CAS No.57213-48-6

COA

Grade & Purity:

≥98%

Cas Number: 57213-48-6
Molecular Weight: 190.2
PubChem CID: 2734509
PubChem SID: 504761158

In stock

Item Number

C115878

Grouped product items
SKU	Size	Availability	Price
C115878-250mg	250mg	3	$101.90
C115878-1g	1g	2	$248.90
C115878-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$1,120.90
C115878-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$5,040.90

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Amino Acid Derivatives (349)

Basic Description

Synonyms	3-cyano-(S)-phenylalanine \| DS-10624 \| Q27453702 \| A50118 \| H-Phe(3-CN)-OH \| ZHUOMTMPTNZOJE-VIFPVBQESA-N \| 3-Cyano-L-phenylalanine \| HY-W015177 \| L-3-Cyanophenylalanine \| l-3-cyano-phenylalanine \| D-Phenylalanine, 3-cyano- \| DTXSID70972669 \| EN300-1168235
Specifications & Purity	≥98%
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 Alpha amino acids and derivatives
        Level7 Phenylalanine 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 - Alpha amino acids and derivatives
Direct Parent	Phenylalanine and derivatives
Alternative Parents	Phenylpropanoic acids L-alpha-amino acids Amphetamines and derivatives Benzonitriles Aralkylamines Amino acids Nitriles Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Phenylalanine or derivatives - 3-phenylpropanoic-acid - Alpha-amino acid - Amphetamine or derivatives - L-alpha-amino acid - Benzonitrile - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Primary aliphatic amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504761158
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504761158
IUPAC Name	(2S)-2-amino-3-(3-cyanophenyl)propanoic acid
INCHI	InChI=1S/C10H10N2O2/c11-6-8-3-1-2-7(4-8)5-9(12)10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m0/s1
InChIKey	ZHUOMTMPTNZOJE-VIFPVBQESA-N
Smiles	C1=CC(=CC(=C1)C#N)CC(C(=O)O)N
Isomeric SMILES	C1=CC(=CC(=C1)C#N)C[C@@H](C(=O)O)N
UN Number	3439
Molecular Weight	190.2
Reaxy-Rn	4138247
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4138247&ln=

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

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

Analytical Chart:

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9 results found

Lot Number	Certificate Type	Date	Item
J1317056	Certificate of Analysis	Jan 03, 2024	C115878
K2309206	Certificate of Analysis	Oct 16, 2023	C115878
K2309207	Certificate of Analysis	Oct 16, 2023	C115878
K2309205	Certificate of Analysis	Oct 16, 2023	C115878
J1815308	Certificate of Analysis	Aug 08, 2022	C115878
J1815307	Certificate of Analysis	Aug 08, 2022	C115878
J1815310	Certificate of Analysis	Aug 08, 2022	C115878
J1815309	Certificate of Analysis	Aug 08, 2022	C115878
I1402114	Certificate of Analysis	Jun 21, 2022	C115878

Chemical and Physical Properties

Molecular Weight	190.200 g/mol
XLogP3	-1.800
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	190.074 Da
Monoisotopic Mass	190.074 Da
Topological Polar Surface Area	87.100 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	256.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
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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