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Home > Other Heterocycles > 90221-75-3
90221-75-3 | bicyclo[2.2.2]octane-2,3-diol
CAS No: 90221-75-3 Catalog No: AG00H6Z8 MDL No:
Product Description
Catalog Number:
AG00H6Z8
Chemical Name:
bicyclo[2.2.2]octane-2,3-diol
CAS Number:
90221-75-3
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
IUPAC Name:
bicyclo[2.2.2]octane-2,3-diol
InChI:
InChI=1S/C8H14O2/c9-7-5-1-2-6(4-3-5)8(7)10/h5-10H,1-4H2
InChI Key:
CAAYXBDSDAWZJZ-UHFFFAOYSA-N
SMILES:
OC1C2CCC(C1O)CC2
NSC Number:
135336
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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