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1257996-82-9 | 5,8-Dioxaspiro[3.4]octane, 2-bromo-
CAS No: 1257996-82-9 Catalog No: AG000ORH MDL No:MFCD20637976
Product Description
Catalog Number:
AG000ORH
Chemical Name:
5,8-Dioxaspiro[3.4]octane, 2-bromo-
CAS Number:
1257996-82-9
Molecular Formula:
C6H9BrO2
Molecular Weight:
193.0385
MDL Number:
MFCD20637976
IUPAC Name:
2-bromo-5,8-dioxaspiro[3.4]octane
InChI:
InChI=1S/C6H9BrO2/c7-5-3-6(4-5)8-1-2-9-6/h5H,1-4H2
InChI Key:
ROJASEXNUCZUED-UHFFFAOYSA-N
SMILES:
BrC1CC2(C1)OCCO2
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.979g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.04g/mol
Monoisotopic Mass:
191.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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