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17344-99-9

17344-99-9 | Alanine, ethyl ester

CAS No: 17344-99-9 Catalog No: AG001YWT MDL No:MFCD00192672

Product Description

Catalog Number:
AG001YWT
Chemical Name:
Alanine, ethyl ester
CAS Number:
17344-99-9
Molecular Formula:
C5H11NO2
Molecular Weight:
117.1463
MDL Number:
MFCD00192672
IUPAC Name:
ethyl 2-aminopropanoate
InChI:
InChI=1S/C5H11NO2/c1-3-8-5(7)4(2)6/h4H,3,6H2,1-2H3
InChI Key:
ROBXZHNBBCHEIQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)[C@@H](N)C

Properties

Complexity:
82.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
117.079g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
117.148g/mol
Monoisotopic Mass:
117.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0

Literature

Title Journal
A convenient allylsilane-N-acyliminium route toward indolizidine and quinolizidine alkaloids. Beilstein journal of organic chemistry 20070101

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