CC(C)C1=CC=C(C=C1)Br
CAS: 586-61-8
Name: 1-bromo-4-propan-2-ylbenzene
SMILES: CC(C)C1=CC=C(C=C1)Br

Molecular Processing

Molecular formula
C9H11Br
Molecular weight
199.09
Exact mass
198.0044
XLogP
3.57
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
1
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
48.23

Supplementary Information

InChIKey: MOZHUOIQYVYEPN-UHFFFAOYSA-N
Synonyme
1-Bromo-4-isopropylbenzene586-61-84-Bromoisopropylbenzenep-BromocumeneBenzene, 1-bromo-4-(1-methylethyl)-EINECS 209-577-5NSC 97223DTXSID7060411pBromocumene4BromocumeneCumene, pbromopBromoisopropylbenzene4Isopropylbromobenzene2(pBromophenyl)propane2(4Bromophenyl)propaneRefChem:75133Cumene, pbromo (8CI)Benzene, 1bromo4(1methylethyl)DTXCID2042438MOZHUOIQYVYEPN-UHFFFAOYSA-N4-Bromocumene4-IsopropylbromobenzeneCumene, p-bromo-p-Bromoisopropylbenzene1-bromo-4-isopropyl-benzene1-bromo-4-propan-2-ylbenzene2-(p-Bromophenyl)propane2-(4-Bromophenyl)propaneMFCD000391591-bromo-4-(propan-2-yl)benzene
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