Cnidilide
-
Cnidilide
structure -
-
CAS No:
3674-03-1
-
Formula:
C12H18O2
-
Chemical Name:
Cnidilide
-
Synonyms:
1(3H)-Isobenzofuranone,3-butyl-3a,4,5,7a-tetrahydro-,(3S,3aS,7aR)-;Phthalide,3-butyl-3a,4,5,7a-tetrahydro-;Cnidilide;1(3H)-Isobenzofuranone,3-butyl-3a,4,5,7a-tetrahydro-,[3S-(3α,3aβ,7aβ)]-;(3S,3aS,7aR)-3-Butyl-3a,4,5,7a-tetrahydro-1(3H)-isobenzofuranone
-
CAS No:
Computed Properties
Molecular Weight:194.27
XLogP3:3.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:194.130679813
Monoisotopic Mass:194.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:14
Complexity:245
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes