C1=CC=C(C=C1)Br
CAS: 108-86-1
Name: bromobenzene
SMILES: C1=CC=C(C=C1)Br

Molecular Processing

Molecular formula
C6H5Br
Molecular weight
157.01
Exact mass
155.9575
XLogP
2.45
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0
Molar refractivity
34.14

Supplementary Information

InChIKey: QARVLSVVCXYDNA-UHFFFAOYSA-N
Synonyms
BROMOBENZENE108-86-1MonobromobenzenePhenyl bromideBenzene, bromo-C6H5BrPhBrNCI-C55492BROMO-BENZENEDTXSID5024637CO4D5J547LNSC-6529CHEBI:3179DTXCID304637RefChem:5616203-623-81-Bromobenzene4-bromobenzenePhenylbromideBR1026MFCD00000055Bromobenzene 100 microg/mL in MethanolBROMOBENZOLbromo benzene3-bromobenzeneHSDB 47SMR000112021CCRIS 5887NSC 6529EINECS 203-623-8
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