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167558-54-5 | Benzenamine, 2-(2,2-dibromoethenyl)-
CAS No: 167558-54-5 Catalog No: AG001XFV MDL No:
Product Description
Catalog Number:
AG001XFV
Chemical Name:
Benzenamine, 2-(2,2-dibromoethenyl)-
CAS Number:
167558-54-5
Molecular Formula:
C8H7Br2N
Molecular Weight:
276.9559
IUPAC Name:
2-(2,2-dibromoethenyl)aniline
InChI:
InChI=1S/C8H7Br2N/c9-8(10)5-6-3-1-2-4-7(6)11/h1-5H,11H2
InChI Key:
DRGSEJHYJTUKMF-UHFFFAOYSA-N
SMILES:
BrC(=Cc1ccccc1N)Br
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.892g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.959g/mol
Monoisotopic Mass:
274.895g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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