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75988-55-5 | 1,4-Dioxaspiro[4.4]non-6-ene, 8-bromo-
CAS No: 75988-55-5 Catalog No: AG005GTB MDL No:
Product Description
Catalog Number:
AG005GTB
Chemical Name:
1,4-Dioxaspiro[4.4]non-6-ene, 8-bromo-
CAS Number:
75988-55-5
Molecular Formula:
C7H9BrO2
Molecular Weight:
205.0492
IUPAC Name:
7-bromo-1,4-dioxaspiro[4.4]non-8-ene
InChI:
InChI=1S/C7H9BrO2/c8-6-1-2-7(5-6)9-3-4-10-7/h1-2,6H,3-5H2
InChI Key:
KJYIGMMQZIKVNE-UHFFFAOYSA-N
SMILES:
BrC1C=CC2(C1)OCCO2
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.979g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.051g/mol
Monoisotopic Mass:
203.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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