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Home > Other Heterocycles > 2630-41-3
2630-41-3 | Bicyclo[2.2.1]heptan-2-one, (1S,4R)-
CAS No: 2630-41-3 Catalog No: AG002SMR MDL No:
Product Description
Catalog Number:
AG002SMR
Chemical Name:
Bicyclo[2.2.1]heptan-2-one, (1S,4R)-
CAS Number:
2630-41-3
Molecular Formula:
C7H10O
Molecular Weight:
110.1537
IUPAC Name:
(1S)-bicyclo[2.2.1]heptan-2-one
InChI:
InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2/t5?,6-/m0/s1
InChI Key:
KPMKEVXVVHNIEY-GDVGLLTNSA-N
SMILES:
O=C1C[C@H]2C[C@@H]1CC2
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
110.073g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.156g/mol
Monoisotopic Mass:
110.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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