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97925-43-4 | 4-Bromoisoxazole
CAS No: 97925-43-4 Catalog No: AG0036OR MDL No:MFCD02179569
Product Description
Catalog Number:
AG0036OR
Chemical Name:
4-Bromoisoxazole
CAS Number:
97925-43-4
Molecular Formula:
C3H2BrNO
Molecular Weight:
147.9581
MDL Number:
MFCD02179569
IUPAC Name:
4-bromo-1,2-oxazole
InChI:
InChI=1S/C3H2BrNO/c4-3-1-5-6-2-3/h1-2H
InChI Key:
IRDVIGFQMLUJAM-UHFFFAOYSA-N
SMILES:
Brc1conc1
Properties
Complexity:
50.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.932g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.959g/mol
Monoisotopic Mass:
146.932g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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