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113560-56-8

113560-56-8 | L-Glutamic acid, 2-methyl-, 5-methyl ester

CAS No: 113560-56-8 Catalog No: AG000901 MDL No:

Product Description

Catalog Number:
AG000901
Chemical Name:
L-Glutamic acid, 2-methyl-, 5-methyl ester
CAS Number:
113560-56-8
Molecular Formula:
C7H12NO4-
Molecular Weight:
174.1745
IUPAC Name:
2-amino-5-methoxy-2-methyl-5-oxopentanoate
InChI:
InChI=1S/C7H13NO4/c1-7(8,6(10)11)4-3-5(9)12-2/h3-4,8H2,1-2H3,(H,10,11)/p-1
InChI Key:
QNPIFKGLAZSWKY-UHFFFAOYSA-M
SMILES:
COC(=O)CC[C@@](C(=O)[O-])(N)C

Properties

Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.077g/mol
Formal Charge:
-1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.176g/mol
Monoisotopic Mass:
174.077g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3  

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