DTXSID10866194

1-[4-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)but-2-enyl]-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane

CAS: 744996-72-3

Molecular Formula	`C16H30N8+2`
Molecular Weight	334.46 g/mol
LogP	0.7
Topological Polar Surface Area	19.4 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	334.25934
Heavy Atoms	24
Complexity	430.0

Chemical Identifiers

CAS Number	744996-72-3
SMILES	`C1N2CN3CN1C[N+](C2)(C3)CC=CC[N+]45CN6CN(C4)CN(C6)C5`
InChIKey	`RHBBTPSZCUVJEU-UHFFFAOYSA-N`

📖 Product Overview

DTXSID10866194 (CAS: 744996-72-3) is a chemical compound with molecular formula C16H30N8+2 and molecular weight 334.46 g/mol. Its IUPAC systematic name is 1-[4-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)but-2-enyl]-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane. LogP 0.7 Topological Polar Surface Area 19.4 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 4 Exact Mass 334.25934 Heavy Atoms 24 Complexity 430.0 InChI Key: RHBBTPSZCUVJEU-UHFFFAOYSA-N. SMILES: C1N2CN3CN1C[N+](C2)(C3)CC=CC[N+]45CN6CN(C4)CN(C6)C5.

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