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Home > Other Heterocycles > 1203707-39-4
1203707-39-4 | {3-oxabicyclo[3.1.0]hexan-1-yl}methanol
CAS No: 1203707-39-4 Catalog No: AG01B5S8 MDL No:MFCD28502001
Product Description
Catalog Number:
AG01B5S8
Chemical Name:
{3-oxabicyclo[3.1.0]hexan-1-yl}methanol
CAS Number:
1203707-39-4
Molecular Formula:
C6H10O2
Molecular Weight:
114.1424
MDL Number:
MFCD28502001
IUPAC Name:
3-oxabicyclo[3.1.0]hexan-1-ylmethanol
InChI:
InChI=1S/C6H10O2/c7-3-6-1-5(6)2-8-4-6/h5,7H,1-4H2
InChI Key:
XSWOPLJKFIQKGK-UHFFFAOYSA-N
SMILES:
OCC12COCC2C1
Properties
Complexity:
113
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:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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