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73711-48-5 | Benzenecarboximidamide, 4-(bromomethyl)-
CAS No: 73711-48-5 Catalog No: AG01FC4X MDL No:
Product Description
Catalog Number:
AG01FC4X
Chemical Name:
Benzenecarboximidamide, 4-(bromomethyl)-
CAS Number:
73711-48-5
Molecular Formula:
C8H9BrN2
Molecular Weight:
213.0745
IUPAC Name:
4-(bromomethyl)benzenecarboximidamide
InChI:
InChI=1S/C8H9BrN2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,5H2,(H3,10,11)
InChI Key:
WYMJEEPUFSHYLQ-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1)C(=N)N
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.995g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.078g/mol
Monoisotopic Mass:
211.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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