Name: 9-(4-methoxy-2,3,6-trimethyl-phenyl)-3,7-dimethyl-nona-2,4,6,8-tetraen-1-oic acid chloride
SMILES:
COc1cc(C)c(C=CC(C)=CC=CC(C)=CC(=O)Cl)c(C)c1CMolecular Processing
Molecular formula
C21H25ClO2
Molecular weight
344.88
Exact mass
344.1543
XLogP
5.85
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.286
Molar refractivity
103.75
Supplementary Information
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Involved in 27 reactions→