200,000+ products from a single source!
sales@angenechem.com
1638487-42-9 | Benzonitrile, 5-(aminomethyl)-2-fluoro-, hydrochloride (1:1)
CAS No: 1638487-42-9 Catalog No: AG001UFT MDL No:
Product Description
Catalog Number:
AG001UFT
Chemical Name:
Benzonitrile, 5-(aminomethyl)-2-fluoro-, hydrochloride (1:1)
CAS Number:
1638487-42-9
Molecular Formula:
C8H8ClFN2
Molecular Weight:
186.6139
IUPAC Name:
5-(aminomethyl)-2-fluorobenzonitrile;hydrochloride
InChI:
InChI=1S/C8H7FN2.ClH/c9-8-2-1-6(4-10)3-7(8)5-11;/h1-3H,4,10H2;1H
InChI Key:
PHWQUARYBMWLOU-UHFFFAOYSA-N
SMILES:
NCc1ccc(c(c1)C#N)F.Cl
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.036g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.614g/mol
Monoisotopic Mass:
186.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.