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1260816-08-7 | Benzeneethanimidamide, 3-chloro-4-fluoro-
CAS No: 1260816-08-7 Catalog No: AG000RDF MDL No:
Product Description
Catalog Number:
AG000RDF
Chemical Name:
Benzeneethanimidamide, 3-chloro-4-fluoro-
CAS Number:
1260816-08-7
Molecular Formula:
C8H8ClFN2
Molecular Weight:
186.6139
IUPAC Name:
2-(3-chloro-4-fluorophenyl)ethanimidamide
InChI:
InChI=1S/C8H8ClFN2/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3H,4H2,(H3,11,12)
InChI Key:
KNYKCZDYIOOUOH-UHFFFAOYSA-N
SMILES:
NC(=N)Cc1ccc(c(c1)Cl)F
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
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:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.614g/mol
Monoisotopic Mass:
186.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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