CC(C)(C)c1cc(Br)cc2c1OCCC2(C)C
SMILES: CC(C)(C)c1cc(Br)cc2c1OCCC2(C)C

Molecular Processing

Molecular formula
C15H21BrO
Molecular weight
297.24
Exact mass
296.0776
XLogP
4.81
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
75.98

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→