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Home > Other Heterocycles > 917906-11-7
917906-11-7 | Methanone, bicyclo[2.2.1]hept-2-yl-2-thienyl-
CAS No: 917906-11-7 Catalog No: AG006BEW MDL No:
Product Description
Catalog Number:
AG006BEW
Chemical Name:
Methanone, bicyclo[2.2.1]hept-2-yl-2-thienyl-
CAS Number:
917906-11-7
Molecular Formula:
C12H14OS
Molecular Weight:
206.3040
IUPAC Name:
2-bicyclo[2.2.1]heptanyl(thiophen-2-yl)methanone
InChI:
InChI=1S/C12H14OS/c13-12(11-2-1-5-14-11)10-7-8-3-4-9(10)6-8/h1-2,5,8-10H,3-4,6-7H2
InChI Key:
KUHTZYDNEGASQY-UHFFFAOYSA-N
SMILES:
O=C(C1CC2CC1CC2)c1cccs1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.077g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.303g/mol
Monoisotopic Mass:
206.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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