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133302-62-2 | Benzenecarboximidamide, 4-bromo-3-fluoro-, hydrochloride (1:1)
CAS No: 133302-62-2 Catalog No: AG0014KP MDL No:MFCD06738565
Product Description
Catalog Number:
AG0014KP
Chemical Name:
Benzenecarboximidamide, 4-bromo-3-fluoro-, hydrochloride (1:1)
CAS Number:
133302-62-2
Molecular Formula:
C7H7BrClFN2
Molecular Weight:
253.4993
MDL Number:
MFCD06738565
IUPAC Name:
4-bromo-3-fluorobenzenecarboximidamide;hydrochloride
InChI:
InChI=1S/C7H6BrFN2.ClH/c8-5-2-1-4(7(10)11)3-6(5)9;/h1-3H,(H3,10,11);1H
InChI Key:
ZABRQARLTWTTQV-UHFFFAOYSA-N
SMILES:
NC(=N)c1ccc(c(c1)F)Br.Cl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.947g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
253.499g/mol
Monoisotopic Mass:
251.947g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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