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160775-51-9 | 1H-Indene-1,3(2H)-dione, 5-bromo-2,2-dimethoxy-
CAS No: 160775-51-9 Catalog No: AG001VC0 MDL No:
Product Description
Catalog Number:
AG001VC0
Chemical Name:
1H-Indene-1,3(2H)-dione, 5-bromo-2,2-dimethoxy-
CAS Number:
160775-51-9
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
IUPAC Name:
5-bromo-2,2-dimethoxyindene-1,3-dione
InChI:
InChI=1S/C11H9BrO4/c1-15-11(16-2)9(13)7-4-3-6(12)5-8(7)10(11)14/h3-5H,1-2H3
InChI Key:
LFSOIGWUVDZDRU-UHFFFAOYSA-N
SMILES:
COC1(OC)C(=O)c2c(C1=O)ccc(c2)Br
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.968g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.093g/mol
Monoisotopic Mass:
283.968g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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