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3-bromo-5-propyl-1,2,4-oxadiazole

3-bromo-5-propyl-1,2,4-oxadiazole

CAS: 1256643-63-6

Formula: C5H7BrN2O

SMILES: CCCC1=NC(Br)=NO1

IUPAC: 3-bromo-5-propyl-1,2,4-oxadiazole

InChI: InChI=1S/C5H7BrN2O/c1-2-3-4-7-5(6)8-9-4/h2-3H2,1H3

Composition: C (31.44%), H (3.69%), Br (41.83%), N (14.66%), O (8.38%)

Molar Mass: 191.028

Atom Count: 16

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 189.974176
Formal Charge 0
FSP3 0.6
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey VEFOSXNCDRYUNJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.44
Topological Polar Surface Area 38.92
Polarizability 14.08
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS UnitPrice
95% <4 Days 1256643-63-6 Quote Only