CC1(CC2=C(O1)C=CC=C2Br)C
CAS: 159020-83-4
Name: 4-bromo-2,2-dimethyl-3H-1-benzofuran
SMILES: CC1(CC2=C(O1)C=CC=C2Br)C

Molecular Processing

Molecular formula
C10H11BrO
Molecular weight
227.1
Exact mass
225.9993
XLogP
3.16
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
12
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
0.4
Molar refractivity
52.55

Supplementary Information

InChIKey: KDPMYODFBRKQSG-UHFFFAOYSA-N
Synonyme
4-BROMO-2,2-DIMETHYL-2,3-DIHYDROBENZOFURAN159020-83-44-BROMO-2,2-DIMETHYL-2,3-DIHYDRO-1-BENZOFURANSCHEMBL8388052KDPMYODFBRKQSG-UHFFFAOYSA-N4-bromo-2,2-dimethyl-3H-benzofuranAB72241AT475954-bromo-2,3-dihydro-2,2-dimethylbenzofuranCS-0379400
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