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208450-52-6 | 1,4-Dioxaspiro[4.4]non-6-ene, 6-bromo-9-methyl-
CAS No: 208450-52-6 Catalog No: AG002JOU MDL No:
Product Description
Catalog Number:
AG002JOU
Chemical Name:
1,4-Dioxaspiro[4.4]non-6-ene, 6-bromo-9-methyl-
CAS Number:
208450-52-6
Molecular Formula:
C8H11BrO2
Molecular Weight:
219.0757
IUPAC Name:
9-bromo-6-methyl-1,4-dioxaspiro[4.4]non-8-ene
InChI:
InChI=1S/C8H11BrO2/c1-6-2-3-7(9)8(6)10-4-5-11-8/h3,6H,2,4-5H2,1H3
InChI Key:
DZINRPUBDXIJNK-UHFFFAOYSA-N
SMILES:
CC1CC=C(C21OCCO2)Br
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.994g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.078g/mol
Monoisotopic Mass:
217.994g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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