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3-ethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

3-ethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

CAS: 791777-96-3

Formula: C7H12N4

SMILES: CCC1=NN=C2CNCCN12

IUPAC: 3-ethyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine

InChI: InChI=1S/C7H12N4/c1-2-6-9-10-7-5-8-3-4-11(6)7/h8H,2-5H2,1H3

Composition: C (55.24%), H (7.95%), N (36.81%)

Molar Mass: 152.201

Atom Count: 23

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 152.106196402
Formal Charge 0
FSP3 0.71
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey KYAGGLONXREQED-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.8
Topological Polar Surface Area 42.74
Polarizability 16.11
Ring Count 2
Rotatable Bond Count 1

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