Home Halogens Benzene, 2-bromo-1,4-bis(1-methylethyl)-

Benzene, 2-bromo-1,4-bis(1-methylethyl)-

CAS No.:
42196-29-2
Catalog Number:
AG00738D
Molecular Formula:
C12H17Br
Molecular Weight:
241.1674
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Product Description
Catalog Number:
AG00738D
Chemical Name:
Benzene, 2-bromo-1,4-bis(1-methylethyl)-
CAS Number:
42196-29-2
Molecular Formula:
C12H17Br
Molecular Weight:
241.1674
MDL Number:
MFCD09965970
IUPAC Name:
2-bromo-1,4-di(propan-2-yl)benzene
InChI:
InChI=1S/C12H17Br/c1-8(2)10-5-6-11(9(3)4)12(13)7-10/h5-9H,1-4H3
InChI Key:
KSFMKBVDTMONEL-UHFFFAOYSA-N
SMILES:
CC(c1ccc(c(c1)Br)C(C)C)C
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.172g/mol
Monoisotopic Mass:
240.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  
Properties