2-(4-Hydroxy-3-nitrophenyl)ethylamine; N-Ac 

AlkaPlorer ID: AK301641

Synonym: N-(4-Hydroxy-3-nitrophenylethyl)acetamide, N-Acetyl-3-nitrotyramine 

IUPAC Name: N-[2-(4-hydroxy-3-nitrophenyl)ethyl]acetamide

Structure

SMILES: CC(O)=NCCC1=CC=C(O)C([N+](=O)[O-])=C1

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InChI: InChI=1S/C10H12N2O4/c1-7(13)11-5-4-8-2-3-10(14)9(6-8)12(15)16/h2-3,6,14H,4-5H2,1H3,(H,11,13)

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InChIKey: LBZQSQYRGCAOJM-UHFFFAOYSA-N

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Reference

PubChem CID: 14778429

CAS: 134779-32-1

SuperNatural Ⅲ: SN0201412

NPASS: NPC15711

Properties Information

Molecule Weight: 224.216

TPSA: 95.96

MolLogP: 1.8193

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information