Molecular Identity
Isoamyl 2-cyanoacrylate
3-methylbutyl 2-cyanoprop-2-enoate
PubChem CID: 29626
2D Structure
Properties
C9H13NO2
Molecular Formula
167.20
Molecular Weight
g/mol
167.0946
Exact Mass
Da
2.3
XLogP
Drug-like (Lipinski: < 5)
50.1
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
3
H-Bond Acceptors
222
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Isoamyl 2-cyanoacrylateisopentyl 2-cyanoacrylate3-methylbutyl 2-cyanoprop-2-enoate19475-26-4isoamyl cyanoacrylate2-Propenoic acid, 2-cyano-, 3-methylbutyl ester3977IRA64JACRYLIC ACID, 2-CYANO-, ISOPENTYL ESTERDTXSID30173115isopentyl cyanoacrylateRefChem:148993DTXCID7095606BRN 1934875UNII-3977IRA64Jiso amyl2-cyanoacrylate
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Isoamyl 2-cyanoacrylate
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