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Home > Other Heterocycles > 68211-36-9
68211-36-9 | bicyclo[2.2.2]oct-2-en-1-ol
CAS No: 68211-36-9 Catalog No: AG01DE4G MDL No:MFCD00213770
Product Description
Catalog Number:
AG01DE4G
Chemical Name:
bicyclo[2.2.2]oct-2-en-1-ol
CAS Number:
68211-36-9
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD00213770
IUPAC Name:
bicyclo[2.2.2]oct-2-en-1-ol
InChI:
InChI=1S/C8H12O/c9-8-4-1-7(2-5-8)3-6-8/h1,4,7,9H,2-3,5-6H2
InChI Key:
YTZYREKPCQTYTM-UHFFFAOYSA-N
SMILES:
OC12CCC(CC1)C=C2
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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