CC1=C(C=C(C=C1)CO)Br
CAS: 68120-35-4
Name: (3-bromo-4-methylphenyl)methanol
SMILES: CC1=C(C=C(C=C1)CO)Br

Molecular Processing

Molecular formula
C8H9BrO
Molecular weight
201.06
Exact mass
199.9837
XLogP
2.25
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
44.8

Supplementary Information

InChIKey: ZRBDUKUJADUIEO-UHFFFAOYSA-N
Synonyme
(3-BROMO-4-METHYLPHENYL)METHANOL68120-35-4DTXSID20513647RefChem:207544DTXCID304644543-bromo-4-methylbenzyl alcoholMFCD12031922Benzenemethanol, 3-bromo-4-methyl-SCHEMBL1467659SCHEMBL16951642SCHEMBL27886022ZRBDUKUJADUIEO-UHFFFAOYSA-N(3-bromo-4-methyl-phenyl)methanol(3-Bromo-4-methyl-phenyl)-methanolAKOS0160081713-Bromo-4-methylbenzyl alcohol, 97%FS-5165SY030171DB-366168CS-0031361EN300-156755F50128F234700Z1269190523
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