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Home > Bromides > 1260013-03-3
1260013-03-3 | 1H-Inden-1-one, 4-bromo-7-chloro-2,3-dihydro-
CAS No: 1260013-03-3 Catalog No: AG000QQ9 MDL No:MFCD18208168
Product Description
Catalog Number:
AG000QQ9
Chemical Name:
1H-Inden-1-one, 4-bromo-7-chloro-2,3-dihydro-
CAS Number:
1260013-03-3
Molecular Formula:
C9H6BrClO
Molecular Weight:
245.5003
MDL Number:
MFCD18208168
IUPAC Name:
4-bromo-7-chloro-2,3-dihydroinden-1-one
InChI:
InChI=1S/C9H6BrClO/c10-6-2-3-7(11)9-5(6)1-4-8(9)12/h2-3H,1,4H2
InChI Key:
MILQBZVMFHXNNO-UHFFFAOYSA-N
SMILES:
O=C1CCc2c1c(Cl)ccc2Br
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.929g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.5g/mol
Monoisotopic Mass:
243.929g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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