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3-[(3-Fluorophenyl)amino]propanoic Acid - 95%, high purity , CAS No.885275-89-8

COA

Grade & Purity:

≥95%

Cas Number: 885275-89-8
Molecular Weight: 183.18
MDL number: MFCD07784303
PubChem CID: 17244968

In stock

Item Number

F300950

Grouped product items
SKU	Size	Availability	Price	Qty
F300950-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$114.90
F300950-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$340.90

Discover 3-[(3-Fluorophenyl)amino]propanoic Acid by Aladdin Scientific in 95% for only $114.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	3-[(3-Fluorophenyl)amino]propanoic acid \| 885275-89-8 \| 3-(3-fluoroanilino)propanoic acid \| 3-((3-Fluorophenyl)amino)propanoic acid \| MFCD07784303 \| 3-[(3-Fluorophenyl)amino]propionic acid \| 3-Fluorophenyl-DL-beta-alanine \| N-(3-Fluorophenyl)-b-alanine \| SCHEMBL3121096 \| D
Specifications & Purity	≥95%
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	Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Fluorobenzenes Aryl fluorides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Beta amino acid or derivatives - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Amino acid - Secondary amine - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - 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

IUPAC Name	3-(3-fluoroanilino)propanoic acid
INCHI	InChI=1S/C9H10FNO2/c10-7-2-1-3-8(6-7)11-5-4-9(12)13/h1-3,6,11H,4-5H2,(H,12,13)
InChIKey	WKMPTGFIUPPIGN-UHFFFAOYSA-N
Smiles	C1=CC(=CC(=C1)F)NCCC(=O)O
Isomeric SMILES	C1=CC(=CC(=C1)F)NCCC(=O)O
Molecular Weight	183.18
Reaxy-Rn	20213190
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=20213190&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	183.180 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	183.07 Da
Monoisotopic Mass	183.07 Da
Topological Polar Surface Area	49.300 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	175.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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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