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(3-bromo-1,2,4-oxadiazol-5-yl)methanol

(3-bromo-1,2,4-oxadiazol-5-yl)methanol

CAS: 1781503-14-7

Formula: C3H3BrN2O2

SMILES: OCC1=NC(Br)=NO1

IUPAC: (3-bromo-1,2,4-oxadiazol-5-yl)methanol

InChI: InChI=1S/C3H3BrN2O2/c4-3-5-2(1-7)8-6-3/h7H,1H2

Composition: C (20.13%), H (1.69%), Br (44.65%), N (15.65%), O (17.88%)

Molar Mass: 178.973

Atom Count: 11

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 177.93779
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey QBKYPYIYAQWXOR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.91
Topological Polar Surface Area 59.15
Polarizability 11.37
Ring Count 1
Rotatable Bond Count 1

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96% <2 Days 1781503-14-7 $540.50-$6,762.00$540.50$966.00$1,817.00$6,762.00
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