Name: 1,3,3-trichloro-2-prop-2-enyl-7-oxabicyclo[4.1.0]heptane
SMILES:
C=CCC1C(CCC2C1(O2)Cl)(Cl)ClMolecular Processing
Molecular formula
C9H11Cl3O
Molecular weight
241.54
Exact mass
239.9875
XLogP
3.48
TPSA
12.53
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
55.43
Supplementary Information
InChIKey: SOSNPPJNYXWUHE-UHFFFAOYSA-N
Synonyms
SCHEMBL9250506SOSNPPJNYXWUHE-UHFFFAOYSA-N2allyl,1,3,3-trichloro-7-oxabicyclo[4.1.0]heptane2-allyl-1,3,3-trichloro-7-oxabicyclo[4.1.0]heptane
Involved in 6 reactions→