200,000+ products from a single source!
sales@angenechem.com
179898-34-1 | Benzonitrile, 3-bromo-5-fluoro-
CAS No: 179898-34-1 Catalog No: AG0027CM MDL No:MFCD04038227
Product Description
Catalog Number:
AG0027CM
Chemical Name:
Benzonitrile, 3-bromo-5-fluoro-
CAS Number:
179898-34-1
Molecular Formula:
C7H3BrFN
Molecular Weight:
200.0078
MDL Number:
MFCD04038227
IUPAC Name:
3-bromo-5-fluorobenzonitrile
InChI:
InChI=1S/C7H3BrFN/c8-6-1-5(4-10)2-7(9)3-6/h1-3H
InChI Key:
IADLVSLZPQYXIF-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)cc(c1)Br
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.943g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.01g/mol
Monoisotopic Mass:
198.943g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.