N-((Benzyloxy)carbonyl)aspartic acid

2-(phenylmethoxycarbonylamino)butanedioic acid

CAS: 4515-21-3

Molecular Formula	`C12H13NO6`
Molecular Weight	267.23 g/mol
LogP	0.6
Topological Polar Surface Area	113.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	267.07428
Heavy Atoms	19
Complexity	337.0

Chemical Identifiers

CAS Number	4515-21-3
SMILES	`C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)O`
InChIKey	`XYXYXSKSTZAEJW-UHFFFAOYSA-N`

📖 Product Overview

N-((Benzyloxy)carbonyl)aspartic acid (CAS: 4515-21-3) is a chemical compound with molecular formula C12H13NO6 and molecular weight 267.23 g/mol. Its IUPAC systematic name is 2-(phenylmethoxycarbonylamino)butanedioic acid. LogP 0.6 Topological Polar Surface Area 113.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 7 Exact Mass 267.07428 Heavy Atoms 19 Complexity 337.0 InChI Key: XYXYXSKSTZAEJW-UHFFFAOYSA-N. SMILES: C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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