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148581-37-7 | Benzene, 1-[(1R)-1-bromoethyl]-4-(2-methylpropyl)-
CAS No: 148581-37-7 Catalog No: AG001L11 MDL No:
Product Description
Catalog Number:
AG001L11
Chemical Name:
Benzene, 1-[(1R)-1-bromoethyl]-4-(2-methylpropyl)-
CAS Number:
148581-37-7
Molecular Formula:
C12H17Br
Molecular Weight:
241.1674
IUPAC Name:
1-(1-bromoethyl)-4-(2-methylpropyl)benzene
InChI:
InChI=1S/C12H17Br/c1-9(2)8-11-4-6-12(7-5-11)10(3)13/h4-7,9-10H,8H2,1-3H3
InChI Key:
WHSROYYJBJDRBV-UHFFFAOYSA-N
SMILES:
CC(Cc1ccc(cc1)[C@H](Br)C)C
Properties
Complexity:
134
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:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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