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823189-04-4 | Benzene, 1-(azidomethyl)-3,5-dibromo-
CAS No: 823189-04-4 Catalog No: AG004ZJK MDL No:
Product Description
Catalog Number:
AG004ZJK
Chemical Name:
Benzene, 1-(azidomethyl)-3,5-dibromo-
CAS Number:
823189-04-4
Molecular Formula:
C7H5Br2N3
Molecular Weight:
290.9427
IUPAC Name:
1-(azidomethyl)-3,5-dibromobenzene
InChI:
InChI=1S/C7H5Br2N3/c8-6-1-5(4-11-12-10)2-7(9)3-6/h1-3H,4H2
InChI Key:
XAQDINRXBMSLDJ-UHFFFAOYSA-N
SMILES:
Brc1cc(CN=[N+]=[N-])cc(c1)Br
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.883g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.946g/mol
Monoisotopic Mass:
288.885g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
14.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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