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Home > Other Heterocycles > 2060007-65-8
2060007-65-8 | {2-oxabicyclo[2.1.1]hexan-1-yl}methanol
CAS No: 2060007-65-8 Catalog No: AG01BYKQ MDL No:MFCD30486978
Product Description
Catalog Number:
AG01BYKQ
Chemical Name:
{2-oxabicyclo[2.1.1]hexan-1-yl}methanol
CAS Number:
2060007-65-8
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
MDL Number:
MFCD30486978
IUPAC Name:
2-oxabicyclo[2.1.1]hexan-1-ylmethanol
InChI:
InChI=1S/C6H10O2/c7-4-6-1-5(2-6)3-8-6/h5,7H,1-4H2
InChI Key:
DISAAIHTGSBMRS-UHFFFAOYSA-N
SMILES:
OCC12OCC(C1)C2
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
114.144g/mol
Monoisotopic Mass:
114.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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