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951893-51-9 | 2-Bromo-3-(2,3,5,6-tetramethylphenyl)-1-propene
CAS No: 951893-51-9 Catalog No: AG01F035 MDL No:
Product Description
Catalog Number:
AG01F035
Chemical Name:
2-Bromo-3-(2,3,5,6-tetramethylphenyl)-1-propene
CAS Number:
951893-51-9
Molecular Formula:
C13H17Br
Molecular Weight:
253.1781
IUPAC Name:
3-(2-bromoprop-2-enyl)-1,2,4,5-tetramethylbenzene
InChI:
InChI=1S/C13H17Br/c1-8-6-9(2)12(5)13(11(8)4)7-10(3)14/h6H,3,7H2,1-2,4-5H3
InChI Key:
CLVOVVRIDGAPCN-UHFFFAOYSA-N
SMILES:
BrC(=C)Cc1c(C)c(C)cc(c1C)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.051g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.183g/mol
Monoisotopic Mass:
252.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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