200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 88853-67-2
88853-67-2 | 6,8-Dioxabicyclo[3.2.1]octan-7-one, (1S)-
CAS No: 88853-67-2 Catalog No: AG0049ZJ MDL No:
Product Description
Catalog Number:
AG0049ZJ
Chemical Name:
6,8-Dioxabicyclo[3.2.1]octan-7-one, (1S)-
CAS Number:
88853-67-2
Molecular Formula:
C6H8O3
Molecular Weight:
128.1259
IUPAC Name:
6,8-dioxabicyclo[3.2.1]octan-7-one
InChI:
InChI=1S/C6H8O3/c7-6-4-2-1-3-5(8-4)9-6/h4-5H,1-3H2
InChI Key:
FDTQYEHORIQWRC-UHFFFAOYSA-N
SMILES:
O=C1OC2O[C@H]1CCC2
EC Number:
226-061-5
NSC Number:
55666
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.047g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.127g/mol
Monoisotopic Mass:
128.047g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.