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129316-09-2 | 1,3-Dibromo-5-tert-butylbenzene
CAS No: 129316-09-2 Catalog No: AG0039DM MDL No:MFCD06657956
Product Description
Catalog Number:
AG0039DM
Chemical Name:
1,3-Dibromo-5-tert-butylbenzene
CAS Number:
129316-09-2
Molecular Formula:
C10H12Br2
Molecular Weight:
292.0103
MDL Number:
MFCD06657956
IUPAC Name:
1,3-dibromo-5-tert-butylbenzene
InChI:
InChI=1S/C10H12Br2/c1-10(2,3)7-4-8(11)6-9(12)5-7/h4-6H,1-3H3
InChI Key:
SSPNOMJZVHXOII-UHFFFAOYSA-N
SMILES:
CC(c1cc(Br)cc(c1)Br)(C)C
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.929g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.014g/mol
Monoisotopic Mass:
289.931g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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