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1159823-24-1 | Benzenamine, 3-bromo-N-methyl-, hydrobromide (1:1)
CAS No: 1159823-24-1 Catalog No: AG000HAY MDL No:
Product Description
Catalog Number:
AG000HAY
Chemical Name:
Benzenamine, 3-bromo-N-methyl-, hydrobromide (1:1)
CAS Number:
1159823-24-1
Molecular Formula:
C7H9Br2N
Molecular Weight:
266.9611
IUPAC Name:
3-bromo-N-methylaniline;hydrobromide
InChI:
InChI=1S/C7H8BrN.BrH/c1-9-7-4-2-3-6(8)5-7;/h2-5,9H,1H3;1H
InChI Key:
OPLNVRLVTQPHCH-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1)Br.Br
Properties
Complexity:
85
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.908g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
266.964g/mol
Monoisotopic Mass:
264.91g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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