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1-(5-phenyl-1,2,4-oxadiazol-3-yl)methanamine

1-(5-phenyl-1,2,4-oxadiazol-3-yl)methanamine

CAS: 883545-92-4

Formula: C9H9N3O

SMILES: NCC1=NOC(=N1)C1=CC=CC=C1

IUPAC: 1-(5-phenyl-1,2,4-oxadiazol-3-yl)methanamine

InChI: InChI=1S/C9H9N3O/c10-6-8-11-9(13-12-8)7-4-2-1-3-5-7/h1-5H,6,10H2

Composition: C (61.70%), H (5.18%), N (23.99%), O (9.13%)

Molar Mass: 175.191

Atom Count: 22

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 175.074561922
Formal Charge 0
FSP3 0.11
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey JEFIFQRLLDJFSE-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.76
Topological Polar Surface Area 64.94
Polarizability 19.08
Ring Count 2
Rotatable Bond Count 2

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95% <2 Days 883545-92-4 $51.35-$265.48$51.35$63.37$86.31$265.48
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