Compound C9H16Cl2N4

1-(2-chloroprop-2-enyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane chloride

CAS: 101914-01-6

Molecular Formula	`C9H16Cl2N4`
Molecular Weight	251.15 g/mol
Topological Polar Surface Area	9.7 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	2
Exact Mass	250.0752
Heavy Atoms	15
Complexity	237.0

Chemical Identifiers

CAS Number	101914-01-6
SMILES	`C=C(C[N+]12CN3CN(C1)CN(C3)C2)Cl.[Cl-]`
InChIKey	`NQYBHJCRYFEONJ-UHFFFAOYSA-M`

📖 Product Overview

Compound C9H16Cl2N4 (CAS: 101914-01-6) is a chemical compound with molecular formula C9H16Cl2N4 and molecular weight 251.15 g/mol. Its IUPAC systematic name is 1-(2-chloroprop-2-enyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane chloride. Topological Polar Surface Area 9.7 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 2 Exact Mass 250.0752 Heavy Atoms 15 Complexity 237.0 InChI Key: NQYBHJCRYFEONJ-UHFFFAOYSA-M. SMILES: C=C(C[N+]12CN3CN(C1)CN(C3)C2)Cl.[Cl-].

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