4-methylpiperazine-1-sulfonyl chloride hydrochloride

4-methylpiperazine-1-sulfonyl chloride hydrochloride

CAS: 33581-96-3

Formula: C5H12Cl2N2O2S

SMILES: Cl.CN1CCN(CC1)S(Cl)(=O)=O

IUPAC: 4-methylpiperazine-1-sulfonyl chloride hydrochloride

InChI: InChI=1S/C5H11ClN2O2S.ClH/c1-7-2-4-8(5-3-7)11(6,9)10;/h2-5H2,1H3;1H

Composition: C (25.54%), H (5.14%), Cl (30.15%), N (11.91%), O (13.61%), S (13.64%)

Molar Mass: 235.12

Atom Count: 24

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	233.9996542
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	AYGQXEFMLQQXOD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.72
Topological Polar Surface Area	40.62
Polarizability	18.07
Ring Count	1
Rotatable Bond Count	0

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95%	<4 Days	33581-96-3		$88.55-$1,107.45$88.55$177.10$495.65$1,107.45