Molecular Identity
ISOAMYL NITRITE
3-methylbutyl nitrite
PubChem CID: 8053
Isoamyl nitrite is a nitrite ester having isopentyl as the alkyl group. It has a role as a vasodilator agent and an antihypertensive agent. It is functionally related to an isoamylol.
2D Structure
Properties
C5H11NO2
Molecular Formula
117.15
Molecular Weight
g/mol
117.0790
Exact Mass
Da
1.7
XLogP
Drug-like (Lipinski: < 5)
38.7
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
3
H-Bond Acceptors
63
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
ISOAMYL NITRITEIsopentyl nitrite110-46-33-Methylbutyl nitriteVaporoleAmilnitriteAspiralNitrous acid, 3-methylbutyl ester3-Methylbutanol nitritePentanoli nitrisNitrous acid, isopentyl esterIsopentyl alcohol, nitriteAmyl nitrosum5N0U5TUC9ZDTXSID9025455
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to ISOAMYL NITRITE
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