Name: 5-methyl-2,3-dihydro-benzo[1,4]dioxine-6-carbonyl chloride
SMILES:
Cc1c(C(=O)Cl)ccc2c1OCCO2Molecular Processing
Molecular formula
C10H9ClO3
Molecular weight
212.63
Exact mass
212.024
XLogP
2.15
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
52.35
Supplementary Information
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