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N-METHYL-DL-GLUTAMIC ACID

CAS No.:
35989-16-3
Catalog Number:
AG003T7K
Molecular Formula:
C6H11NO4
Molecular Weight:
161.1558
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Product Description
Catalog Number:
AG003T7K
Chemical Name:
N-METHYL-DL-GLUTAMIC ACID
CAS Number:
35989-16-3
Molecular Formula:
C6H11NO4
Molecular Weight:
161.1558
MDL Number:
MFCD00059960
IUPAC Name:
2-(methylamino)pentanedioic acid
InChI:
InChI=1S/C6H11NO4/c1-7-4(6(10)11)2-3-5(8)9/h4,7H,2-3H2,1H3,(H,8,9)(H,10,11)
InChI Key:
XLBVNMSMFQMKEY-UHFFFAOYSA-N
SMILES:
CNC(C(=O)O)CCC(=O)O
NSC Number:
109187
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.069g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
161.157g/mol
Monoisotopic Mass:
161.069g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-3  
Properties