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1646-53-3 | Benzene, 3-bromo-1,2,4,5-tetramethyl-
CAS No: 1646-53-3 Catalog No: AG001UZ8 MDL No:MFCD00000070
Product Description
Catalog Number:
AG001UZ8
Chemical Name:
Benzene, 3-bromo-1,2,4,5-tetramethyl-
CAS Number:
1646-53-3
Molecular Formula:
C10H13Br
Molecular Weight:
213.1142
MDL Number:
MFCD00000070
IUPAC Name:
3-bromo-1,2,4,5-tetramethylbenzene
InChI:
InChI=1S/C10H13Br/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,1-4H3
InChI Key:
WJKBPTLQJXKEHC-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1C)Br)C
EC Number:
216-707-4
NSC Number:
87881
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.02g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.118g/mol
Monoisotopic Mass:
212.02g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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