1-{2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methanamine hydrate dihydrochloride

1-{2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methanamine hydrate dihydrochloride

Formula: C7H15Cl2N3O

SMILES: O.Cl.Cl.NCC1=C2CCCC2=NN1

IUPAC: 1-{2H,4H,5H,6H-cyclopenta[c]pyrazol-3-yl}methanamine hydrate dihydrochloride

InChI: InChI=1S/C7H11N3.2ClH.H2O/c8-4-7-5-2-1-3-6(5)9-10-7;;;/h1-4,8H2,(H,9,10);2*1H;1H2

Composition: C (36.86%), H (6.63%), Cl (31.08%), N (18.42%), O (7.01%)

Molar Mass: 228.12

Atom Count: 28

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	227.0592175
Formal Charge	0
FSP3	0.57
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	QMXOOXWTBBPPOP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	40.55
Topological Polar Surface Area	54.7
Polarizability	15.14
Ring Count	2
Rotatable Bond Count	1

Suppliers

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<4 Days	C7H15Cl2N3O		$80.50-$302.45$80.50$124.20$302.45