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Home > Other Heterocycles > 286-16-8
286-16-8 | 2-Oxabicyclo[4.1.0]heptane
CAS No: 286-16-8 Catalog No: AG002VU0 MDL No:MFCD20486280
Product Description
Catalog Number:
AG002VU0
Chemical Name:
2-Oxabicyclo[4.1.0]heptane
CAS Number:
286-16-8
Molecular Formula:
C6H10O
Molecular Weight:
98.1430
MDL Number:
MFCD20486280
IUPAC Name:
2-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C6H10O/c1-2-5-4-6(5)7-3-1/h5-6H,1-4H2
InChI Key:
WRQOPPZJPSGEDO-UHFFFAOYSA-N
SMILES:
C1COC2C(C1)C2
Properties
Complexity:
80.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
98.073g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
98.145g/mol
Monoisotopic Mass:
98.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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