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Home > Other Heterocycles > 2778-68-9
2778-68-9 | Bicyclo[4.1.0]heptane, 3,7,7-trimethyl-, (1S,3S,6R)-
CAS No: 2778-68-9 Catalog No: AG002UQY MDL No:
Product Description
Catalog Number:
AG002UQY
Chemical Name:
Bicyclo[4.1.0]heptane, 3,7,7-trimethyl-, (1S,3S,6R)-
CAS Number:
2778-68-9
Molecular Formula:
C10H18
Molecular Weight:
138.2499
IUPAC Name:
(1S,3S,6R)-3,7,7-trimethylbicyclo[4.1.0]heptane
InChI:
InChI=1S/C10H18/c1-7-4-5-8-9(6-7)10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8+,9-/m0/s1
InChI Key:
BWRHOYDPVJPXMF-YIZRAAEISA-N
SMILES:
C[C@H]1CC[C@@H]2[C@H](C1)C2(C)C
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
138.141g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.254g/mol
Monoisotopic Mass:
138.141g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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