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1-butyl-1-methylpyrrolidin-1-ium chloride

1-butyl-1-methylpyrrolidin-1-ium chloride

CAS: 479500-35-1

Formula: C9H20ClN

SMILES: [Cl-].CCCC[N+]1(C)CCCC1

IUPAC: 1-butyl-1-methylpyrrolidin-1-ium chloride

InChI: InChI=1S/C9H20N.ClH/c1-3-4-7-10(2)8-5-6-9-10;/h3-9H2,1-2H3;1H/q+1;/p-1

Composition: C (60.83%), H (11.34%), Cl (19.95%), N (7.88%)

Molar Mass: 177.72

Atom Count: 31

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 177.1284273
Formal Charge 0
FSP3 1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey BOOXKGZZTBKJFE-UHFFFAOYSA-M
Lipinski's Rule of Five 1
Molar Refractivity 57.32
Topological Polar Surface Area 0
Polarizability 18.06
Ring Count 1
Rotatable Bond Count 3

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