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832734-09-5 | Benzenamine, 4,5-dibromo-2-(2-bromophenoxy)-N-methyl-
CAS No: 832734-09-5 Catalog No: AG004TB7 MDL No:
Product Description
Catalog Number:
AG004TB7
Chemical Name:
Benzenamine, 4,5-dibromo-2-(2-bromophenoxy)-N-methyl-
CAS Number:
832734-09-5
Molecular Formula:
C13H10Br3NO
Molecular Weight:
435.9366
IUPAC Name:
4,5-dibromo-2-(2-bromophenoxy)-N-methylaniline
InChI:
InChI=1S/C13H10Br3NO/c1-17-11-6-9(15)10(16)7-13(11)18-12-5-3-2-4-8(12)14/h2-7,17H,1H3
InChI Key:
HERLPXIZHSJKHY-UHFFFAOYSA-N
SMILES:
CNc1cc(Br)c(cc1Oc1ccccc1Br)Br
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
434.829g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
435.941g/mol
Monoisotopic Mass:
432.831g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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