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2852-69-9 | 2,5-Cyclohexadien-1-one, 2,6-dibromo-4-imino-
CAS No: 2852-69-9 Catalog No: AG002VMF MDL No:
Product Description
Catalog Number:
AG002VMF
Chemical Name:
2,5-Cyclohexadien-1-one, 2,6-dibromo-4-imino-
CAS Number:
2852-69-9
Molecular Formula:
C6H3Br2NO
Molecular Weight:
264.9021
IUPAC Name:
2,6-dibromo-4-iminocyclohexa-2,5-dien-1-one
InChI:
InChI=1S/C6H3Br2NO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,9H
InChI Key:
VTYCYFFHLFIUNW-UHFFFAOYSA-N
SMILES:
N=C1C=C(Br)C(=O)C(=C1)Br
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.856g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.904g/mol
Monoisotopic Mass:
262.858g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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