200,000+ products from a single source!
sales@angenechem.com
501939-46-4 | [3-(4-Bromo-3-fluoro-phenyl)-4,5-dihydro-isoxazol-5-yl]-methanol
CAS No: 501939-46-4 Catalog No: AG01F5WT MDL No:
Product Description
Catalog Number:
AG01F5WT
Chemical Name:
[3-(4-Bromo-3-fluoro-phenyl)-4,5-dihydro-isoxazol-5-yl]-methanol
CAS Number:
501939-46-4
Molecular Formula:
C10H9BrFNO2
Molecular Weight:
274.0864
IUPAC Name:
[3-(4-bromo-3-fluorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanol
InChI:
InChI=1S/C10H9BrFNO2/c11-8-2-1-6(3-9(8)12)10-4-7(5-14)15-13-10/h1-3,7,14H,4-5H2
InChI Key:
SBNGXSCCHPUWFR-UHFFFAOYSA-N
SMILES:
OCC1ON=C(C1)c1ccc(c(c1)F)Br
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.98g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
274.089g/mol
Monoisotopic Mass:
272.98g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.