methyl 2-(2-nitrophenyl)acetate

AlkaPlorer ID: AK318487

Synonym: None

IUPAC Name: methyl 2-(2-nitrophenyl)acetate

Structure

SMILES: COC(=O)CC1=CC=CC=C1[N+](=O)[O-]

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InChI: InChI=1S/C9H9NO4/c1-14-9(11)6-7-4-2-3-5-8(7)10(12)13/h2-5H,6H2,1H3

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InChIKey: SWMFAAPTSMVULA-UHFFFAOYSA-N

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Reference

PubChem CID: 520464

CAS: 30095-98-8

NPASS: NPC129039

Properties Information

Molecule Weight: 195.174

TPSA: 69.44

MolLogP: 1.3102999999999998

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information