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Home > Other Heterocycles > 18172-67-3
18172-67-3 | Bicyclo[3.1.1]heptane, 6,6-dimethyl-2-methylene-, (1S,5S)-
CAS No: 18172-67-3 Catalog No: AG00232W MDL No:MFCD00001345
Product Description
Catalog Number:
AG00232W
Chemical Name:
Bicyclo[3.1.1]heptane, 6,6-dimethyl-2-methylene-, (1S,5S)-
CAS Number:
18172-67-3
Molecular Formula:
C10H16
Molecular Weight:
136.2340
MDL Number:
MFCD00001345
IUPAC Name:
(1S,5S)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane
InChI:
InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9-/m0/s1
InChI Key:
WTARULDDTDQWMU-IUCAKERBSA-N
SMILES:
C=C1CC[C@H]2C[C@@H]1C2(C)C
EC Number:
242-060-2
UNII:
AFN153A7SU
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
136.125g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.238g/mol
Monoisotopic Mass:
136.125g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Literature
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