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Home > Bromides > 1251032-65-1
1251032-65-1 | Benzene, 1-bromo-2-chloro-4-(1,1-dimethylethyl)-
CAS No: 1251032-65-1 Catalog No: AG000N74 MDL No:MFCD18072806
Product Description
Catalog Number:
AG000N74
Chemical Name:
Benzene, 1-bromo-2-chloro-4-(1,1-dimethylethyl)-
CAS Number:
1251032-65-1
Molecular Formula:
C10H12BrCl
Molecular Weight:
247.5593
MDL Number:
MFCD18072806
IUPAC Name:
1-bromo-4-tert-butyl-2-chlorobenzene
InChI:
InChI=1S/C10H12BrCl/c1-10(2,3)7-4-5-8(11)9(12)6-7/h4-6H,1-3H3
InChI Key:
MAEUOFBYQLTZRY-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1Cl)C(C)(C)C
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.981g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.56g/mol
Monoisotopic Mass:
245.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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