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5-[(2S)-pyrrolidin-2-yl]-1H-1,2,3,4-tetrazole

5-[(2S)-pyrrolidin-2-yl]-1H-1,2,3,4-tetrazole

CAS: 33878-70-5

Formula: C5H9N5

SMILES: C1CN[C@@H](C1)C1=NN=NN1

IUPAC: 5-[(2S)-pyrrolidin-2-yl]-1H-1,2,3,4-tetrazole

InChI: InChI=1S/C5H9N5/c1-2-4(6-3-1)5-7-9-10-8-5/h4,6H,1-3H2,(H,7,8,9,10)/t4-/m0/s1

Composition: C (43.15%), H (6.52%), N (50.33%)

Molar Mass: 139.162

Atom Count: 19

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 139.08579531
Formal Charge 0
FSP3 0.8
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey XUHYQIQIENDJER-BYPYZUCNSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.18
Topological Polar Surface Area 66.49
Polarizability 13.6
Ring Count 2
Rotatable Bond Count 1

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