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L-Alanine-15N - (15N, 98%), high purity , CAS No.25713-23-9
Basic Description
Synonyms
L-Alanine-15N, 98 atom % 15N, S & P tested | (2S)-2-(15N)azanylpropanoic acid | MFCD00069943 | L-Alanine-15N | L-ALANINE 15N | HY-N0229S2 | L-Alanine-15N, 98 atom % 15N | DTXSID40473350
Specifications & Purity
≥98 atom% 15N,≥98.5%
Storage Temp
Argon charged
Shipped In
Normal
Taxonomic Classification
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
Alanine and derivatives
Alternative Parents
L-alpha-amino acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Alanine or derivatives - Alpha-amino acid - L-alpha-amino acid - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available
Data sources
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.
Names and Identifiers
Pubchem Sid
504766758
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504766758
IUPAC Name
(2S)-2-(15N)azanylpropanoic acid
INCHI
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1/i4+1
InChIKey
QNAYBMKLOCPYGJ-GZPBOPPUSA-N
Smiles
CC(C(=O)O)N
Isomeric SMILES
C[C@@H](C(=O)O)[15NH2]
WGK Germany
1
Molecular Weight
90.09
Reaxy-Rn
635807
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635807&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Sensitivity
Moisture sensitive
Specific Rotation[α]
[α]25/D +14.5°, c = 2 in 1 M HCl
Melt Point(°C)
314.5°C
Molecular Weight
90.090 g/mol
XLogP3
-3.000
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
90.0447 Da
Monoisotopic Mass
90.0447 Da
Topological Polar Surface Area
63.300 Ų
Heavy Atom Count
6
Formal Charge
0
Complexity
61.800
Isotope Atom Count
1
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
Citations of This Product
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1 Citations
C2401105