2,4-Dinitro-6-octylphenyl crotonate

(2,4-dinitro-6-octylphenyl) but-2-enoate

CAS: 49794-90-3

Molecular Formula	`C18H24N2O6`
Molecular Weight	364.4 g/mol
LogP	6.2
Topological Polar Surface Area	118.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	10
Exact Mass	364.16342
Heavy Atoms	26
Complexity	497.0

Chemical Identifiers

CAS Number	49794-90-3
SMILES	`CCCCCCCCC1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C=CC`
InChIKey	`PMSYHBINVYHTNN-UHFFFAOYSA-N`

📖 Product Overview

2,4-Dinitro-6-octylphenyl crotonate (CAS: 49794-90-3) is a chemical compound with molecular formula C18H24N2O6 and molecular weight 364.4 g/mol. Its IUPAC systematic name is (2,4-dinitro-6-octylphenyl) but-2-enoate. LogP 6.2 Topological Polar Surface Area 118.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 10 Exact Mass 364.16342 Heavy Atoms 26 Complexity 497.0 InChI Key: PMSYHBINVYHTNN-UHFFFAOYSA-N. SMILES: CCCCCCCCC1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C=CC.

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