Iminoaspartic acid structure

Iminoaspartic acid

2-iminobutanedioic acid

CAS: 79067-61-1
Molecular Formula C4H5NO4
Molecular Weight 131.09 g/mol
LogP -0.5
Topological Polar Surface Area 98.5 A2
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 131.02185
Heavy Atoms 9
Complexity 162.0

Chemical Identifiers

CAS Number 79067-61-1
SMILES C(C(=N)C(=O)O)C(=O)O
InChIKey NMUOATVLLQEYHI-UHFFFAOYSA-N

📖 Product Overview

Iminoaspartic acid (CAS: 79067-61-1) is a chemical compound with molecular formula C4H5NO4 and molecular weight 131.09 g/mol. Its IUPAC systematic name is 2-iminobutanedioic acid. LogP -0.5 Topological Polar Surface Area 98.5 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 131.02185 Heavy Atoms 9 Complexity 162.0 InChI Key: NMUOATVLLQEYHI-UHFFFAOYSA-N. SMILES: C(C(=N)C(=O)O)C(=O)O.

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