CC1=C(C=CC=C1Cl)CBr
CAS: 90369-76-9
Name: 1-(bromomethyl)-3-chloro-2-methylbenzene
SMILES: CC1=C(C=CC=C1Cl)CBr

Molecular Processing

Molecular formula
C8H8BrCl
Molecular weight
219.51
Exact mass
217.9498
XLogP
3.54
TPSA
0
H-bond donors
0
H-bond acceptors
0
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
48.82

Supplementary Information

InChIKey: ORGIHYDPMFXTEZ-UHFFFAOYSA-N
Synonyms
1-(Bromomethyl)-3-chloro-2-methylbenzene90369-76-9RefChem:2262043-CHLORO-2-METHYLBENZYL BROMIDEMFCD120250002-(Bromomethyl)-6-chlorotoluene1-(bromomethyl)-3-chloro-2-methyl-benzeneSCHEMBL7246593-chloro-2-methylbenzylbromideORGIHYDPMFXTEZ-UHFFFAOYSA-NDTXSID601274371QDA36976AKOS030629870AS-36891DA-30693SY242400Benzene, 1-(bromomethyl)-3-chloro-2-methyl-EN300-2967225F808417
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Involved in 23 reactions→

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