Molecule

4-(2-Nitroethyl)phenol

AlkaPlorer ID: AK307865

Synonym: 1-(4-Hydroxyphenyl)-2-nitroethane

IUPAC Name: 4-(2-nitroethyl)phenol

SMILES: O=[N+]([O-])CCC1=CC=C(O)C=C1

InChI: InChI=1S/C8H9NO3/c10-8-3-1-7(2-4-8)5-6-9(11)12/h1-4,10H,5-6H2

InChIKey: VUBNQBXWQVHBLU-UHFFFAOYSA-N

PubChem CID: 3082465

CAS: 37567-58-1

LOTUS: LTS0024149

SuperNatural Ⅲ: SN0400125

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
None	Aristolochia	Aristolochiaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Dennettia tripetala	Dennettia	Annonaceae	Magnoliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Trollius chinensis	Trollius	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Aristolochia	Aristolochiaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 167.16400000000002

TPSA？: 63.370000000000005

MolLogP？: 1.2113999999999998

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 1

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi