Name: 8-bromo-4,5-dihydro-6-oxa-1-thia-benzo[e]azulene
SMILES:
Brc1ccc2c(c1)OCCc1ccsc1-2Molecular Processing
Molecular formula
C12H9BrOS
Molecular weight
281.17
Exact mass
279.9557
XLogP
4.11
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
66.65
Supplementary Information
Details werden geladen…
An 5 Reaktionen beteiligt→