lithium(1+) 5-methyl-1,3,4-thiadiazole-2-carboxylate

lithium(1+) 5-methyl-1,3,4-thiadiazole-2-carboxylate

CAS: 1810070-07-5

Formula: C4H3LiN2O2S

SMILES: [Li+].CC1=NN=C(S1)C([O-])=O

IUPAC: lithium(1+) 5-methyl-1,3,4-thiadiazole-2-carboxylate

InChI: InChI=1S/C4H4N2O2S.Li/c1-2-5-6-3(9-2)4(7)8;/h1H3,(H,7,8);/q;+1/p-1

Composition: C (32.01%), H (2.01%), Li (4.62%), N (18.67%), O (21.32%), S (21.36%)

Molar Mass: 150.08

Atom Count: 13

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	150.00752696
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	WWNTUTIEDNLPLZ-UHFFFAOYSA-M
Lipinski's Rule of Five	1
Molar Refractivity	43.4
Topological Polar Surface Area	65.91
Polarizability	11.48
Ring Count	1
Rotatable Bond Count	1

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