1-(3,5-dimethyl-1H-pyrazol-4-yl)methanamine bis(oxalic acid) hydrate

1-(3,5-dimethyl-1H-pyrazol-4-yl)methanamine bis(oxalic acid) hydrate

Formula: C10H17N3O9

SMILES: O.OC(=O)C(O)=O.OC(=O)C(O)=O.CC1=C(CN)C(C)=NN1

IUPAC: 1-(3,5-dimethyl-1H-pyrazol-4-yl)methanamine bis(oxalic acid) hydrate

InChI: InChI=1S/C6H11N3.2C2H2O4.H2O/c1-4-6(3-7)5(2)9-8-4;23-1(4)2(5)6;/h3,7H2,1-2H3,(H,8,9);2(H,3,4)(H,5,6);1H2

Composition: C (37.16%), H (5.30%), N (13.00%), O (44.54%)

Molar Mass: 323.258

Atom Count: 39

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	323.096479139
Formal Charge	0
FSP3	0.3
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	IPLWSSSPRGHSGL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.96
Topological Polar Surface Area	54.7
Polarizability	14.02
Ring Count	1
Rotatable Bond Count	3

Suppliers

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<4 Days	C10H17N3O9		$58.65-$576.15$58.65$186.30$576.15