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1-(3-bromo-1,2-oxazol-5-yl)methanamine

1-(3-bromo-1,2-oxazol-5-yl)methanamine

CAS: 2763-93-1

Formula: C4H5BrN2O

SMILES: NCC1=CC(Br)=NO1

IUPAC: 1-(3-bromo-1,2-oxazol-5-yl)methanamine

InChI: InChI=1S/C4H5BrN2O/c5-4-1-3(2-6)8-7-4/h1H,2,6H2

Composition: C (27.14%), H (2.85%), Br (45.14%), N (15.83%), O (9.04%)

Molar Mass: 177.001

Atom Count: 13

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 175.958526
Formal Charge 0
FSP3 0.25
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey LCFSQWLCIUITOH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 34.32
Topological Polar Surface Area 52.05
Polarizability 12.79
Ring Count 1
Rotatable Bond Count 1

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