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141340-89-8 | Pentanedioic acid, 3-[(2-aminoacetyl)amino]-, 1,5-dimethyl ester
CAS No: 141340-89-8 Catalog No: AG001G8W MDL No:
Product Description
Catalog Number:
AG001G8W
Chemical Name:
Pentanedioic acid, 3-[(2-aminoacetyl)amino]-, 1,5-dimethyl ester
CAS Number:
141340-89-8
Molecular Formula:
C9H16N2O5
Molecular Weight:
232.2337
IUPAC Name:
dimethyl 3-[(2-aminoacetyl)amino]pentanedioate
InChI:
InChI=1S/C9H16N2O5/c1-15-8(13)3-6(4-9(14)16-2)11-7(12)5-10/h6H,3-5,10H2,1-2H3,(H,11,12)
InChI Key:
XGPCVWORKWFCRW-UHFFFAOYSA-N
SMILES:
NCC(=O)NC(CC(=O)OC)CC(=O)OC
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.236g/mol
Monoisotopic Mass:
232.106g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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