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133283-74-6 | Benzene, 1-(5-bromo-2,2-dimethyl-1-methylenepentyl)-4-methyl-
CAS No: 133283-74-6 Catalog No: AG0014JI MDL No:
Product Description
Catalog Number:
AG0014JI
Chemical Name:
Benzene, 1-(5-bromo-2,2-dimethyl-1-methylenepentyl)-4-methyl-
CAS Number:
133283-74-6
Molecular Formula:
C15H21Br
Molecular Weight:
281.2312
IUPAC Name:
1-(6-bromo-3,3-dimethylhex-1-en-2-yl)-4-methylbenzene
InChI:
InChI=1S/C15H21Br/c1-12-6-8-14(9-7-12)13(2)15(3,4)10-5-11-16/h6-9H,2,5,10-11H2,1,3-4H3
InChI Key:
KXMDTLWYDHWPLR-UHFFFAOYSA-N
SMILES:
BrCCCC(C(=C)c1ccc(cc1)C)(C)C
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.083g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.237g/mol
Monoisotopic Mass:
280.083g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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