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Home > Bromides > 1171517-69-3
1171517-69-3 | Benzenecarboximidamide, 4-bromo-2-methyl-, hydrochloride (1:1)
CAS No: 1171517-69-3 Catalog No: AG000DTA MDL No:MFCD04114459
Product Description
Catalog Number:
AG000DTA
Chemical Name:
Benzenecarboximidamide, 4-bromo-2-methyl-, hydrochloride (1:1)
CAS Number:
1171517-69-3
Molecular Formula:
C8H10BrClN2
Molecular Weight:
249.5354
MDL Number:
MFCD04114459
IUPAC Name:
4-bromo-2-methylbenzenecarboximidamide;hydrochloride
InChI:
InChI=1S/C8H9BrN2.ClH/c1-5-4-6(9)2-3-7(5)8(10)11;/h2-4H,1H3,(H3,10,11);1H
InChI Key:
WPVOOWUHTXIQND-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C)C(=N)N.Cl
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.972g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
249.536g/mol
Monoisotopic Mass:
247.972g/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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