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Home > Other Heterocycles > 78472-10-3
78472-10-3 | (1α,6α)-3-Methoxy-5α-hydroxy-7-oxabicyclo[4.1.0]hepta-3-ene-2-one
CAS No: 78472-10-3 Catalog No: AG00GH33 MDL No:
Product Description
Catalog Number:
AG00GH33
Chemical Name:
(1α,6α)-3-Methoxy-5α-hydroxy-7-oxabicyclo[4.1.0]hepta-3-ene-2-one
CAS Number:
78472-10-3
IUPAC Name:
5-hydroxy-3-methoxy-7-oxabicyclo[4.1.0]hept-3-en-2-one
InChI:
InChI=1S/C7H8O4/c1-10-4-2-3(8)6-7(11-6)5(4)9/h2-3,6-8H,1H3
InChI Key:
YDDFVLGMVIJMMI-UHFFFAOYSA-N
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.042g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.137g/mol
Monoisotopic Mass:
156.042g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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