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246139-76-4 | Benzene, 2-bromo-1-(bromomethyl)-4-(1,1-dimethylethyl)-
CAS No: 246139-76-4 Catalog No: AG002ORD MDL No:
Product Description
Catalog Number:
AG002ORD
Chemical Name:
Benzene, 2-bromo-1-(bromomethyl)-4-(1,1-dimethylethyl)-
CAS Number:
246139-76-4
Molecular Formula:
C11H14Br2
Molecular Weight:
306.0369
IUPAC Name:
2-bromo-1-(bromomethyl)-4-tert-butylbenzene
InChI:
InChI=1S/C11H14Br2/c1-11(2,3)9-5-4-8(7-12)10(13)6-9/h4-6H,7H2,1-3H3
InChI Key:
QENZHAWZLQTEIL-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1Br)C(C)(C)C
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.944g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.041g/mol
Monoisotopic Mass:
303.946g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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