N-(Phosphonoacetyl)aspartic acid

2-[(2-phosphonoacetyl)amino]butanedioic acid

CAS: 76338-95-9

Molecular Formula	`C6H10NO8P`
Molecular Weight	255.12 g/mol
LogP	-3.1
Topological Polar Surface Area	161.0 A2
Hydrogen Bond Donors	5
Hydrogen Bond Acceptors	8
Rotatable Bonds	6
Exact Mass	255.0144
Heavy Atoms	16
Complexity	346.0

Chemical Identifiers

CAS Number	76338-95-9
SMILES	`C(C(C(=O)O)NC(=O)CP(=O)(O)O)C(=O)O`
InChIKey	`ZZKNRXZVGOYGJT-UHFFFAOYSA-N`

📖 Product Overview

N-(Phosphonoacetyl)aspartic acid (CAS: 76338-95-9) is a chemical compound with molecular formula C6H10NO8P and molecular weight 255.12 g/mol. Its IUPAC systematic name is 2-[(2-phosphonoacetyl)amino]butanedioic acid. LogP -3.1 Topological Polar Surface Area 161.0 A2 Hydrogen Bond Donors 5 Hydrogen Bond Acceptors 8 Rotatable Bonds 6 Exact Mass 255.0144 Heavy Atoms 16 Complexity 346.0 InChI Key: ZZKNRXZVGOYGJT-UHFFFAOYSA-N. SMILES: C(C(C(=O)O)NC(=O)CP(=O)(O)O)C(=O)O.

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