COc1ccc(Br)c(OC)c1
CAS: 17715-69-4
Nombre: 1-bromo-2,4-dimethoxybenzene
SMILES: COc1ccc(Br)c(OC)c1

Molecular Processing

Molecular formula
C8H9BrO2
Molecular weight
217.06
Exact mass
215.9786
XLogP
2.47
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11
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
0.25
Molar refractivity
47.25

Supplementary Information

InChIKey: NIUZVSQOXJIHBL-UHFFFAOYSA-N
Sinónimos
1-Bromo-2,4-dimethoxybenzene17715-69-42,4-DimethoxybromobenzeneBenzene, 1-bromo-2,4-dimethoxy-1,3-Dimethoxy-4-bromobenzene4-Bromoresorcinol dimethyl ether2,4-Dimethoxyphenyl bromide4-Bromo-1,3-dimethoxybenzene2,4-dimethoxy-1-bromobenzeneQU54UE5GSEEINECS 241-717-0NIUZVSQOXJIHBL-UHFFFAOYSA-DTXSID50170262RefChem:75043DTXCID9092753241-717-0InChI=1/C8H9BrO2/c1-10-6-3-4-7(9)8(5-6)11-2/h3-5H,1-2H3NIUZVSQOXJIHBL-UHFFFAOYSA-NMFCD000098441-Bromo-2,4-dimethoxy-benzene4-bromo-3-methoxyanisoleUNII-QU54UE5GSE2,4-dimethoxy bromobenzenebromo-2,4-dimethoxybenzene4-Bromoresocinol dimethyletherSCHEMBL1670904-Bromoresorcinol dimethyletherorb2939803SCHEMBL3393076SCHEMBL5090699
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