ethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate

CAS: 2544-09-4

Molecular Formula	`C12H17NO4`
Molecular Weight	239.27 g/mol
LogP	1.0
Topological Polar Surface Area	92.8 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	239.11575
Heavy Atoms	17
Complexity	271.0

Chemical Identifiers

CAS Number	2544-09-4
SMILES	`CCOC(=O)C(C)(CC1=CC(=C(C=C1)O)O)N`
InChIKey	`SVEBYYWCXTVYCR-LBPRGKRZSA-N`

📖 Product Overview

ethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate (CAS: 2544-09-4) is a chemical compound with molecular formula C12H17NO4 and molecular weight 239.27 g/mol. Its IUPAC systematic name is ethyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)-2-methylpropanoate. LogP 1.0 Topological Polar Surface Area 92.8 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 5 Exact Mass 239.11575 Heavy Atoms 17 Complexity 271.0 InChI Key: SVEBYYWCXTVYCR-LBPRGKRZSA-N. SMILES: CCOC(=O)C(C)(CC1=CC(=C(C=C1)O)O)N.

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