ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate

CAS: 840-97-1

Molecular Formula	`C13H17NO4`
Molecular Weight	251.28 g/mol
LogP	0.7
Topological Polar Surface Area	75.6 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	251.11575
Heavy Atoms	18
Complexity	285.0

Chemical Identifiers

CAS Number	840-97-1
SMILES	`CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C`
InChIKey	`SKAWDTAMLOJQNK-LBPRGKRZSA-N`

📖 Product Overview

ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate (CAS: 840-97-1) is a chemical compound with molecular formula C13H17NO4 and molecular weight 251.28 g/mol. Its IUPAC systematic name is ethyl (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoate. LogP 0.7 Topological Polar Surface Area 75.6 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 251.11575 Heavy Atoms 18 Complexity 285.0 InChI Key: SKAWDTAMLOJQNK-LBPRGKRZSA-N. SMILES: CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C.

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