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842140-37-8 | 2-BROMO-3-(3,5-DIMETHYLPHENYL)-1-PROPENE
CAS No: 842140-37-8 Catalog No: AG008GN7 MDL No:
Product Description
Catalog Number:
AG008GN7
Chemical Name:
2-BROMO-3-(3,5-DIMETHYLPHENYL)-1-PROPENE
CAS Number:
842140-37-8
Molecular Formula:
C11H13Br
Molecular Weight:
225.1249
IUPAC Name:
1-(2-bromoprop-2-enyl)-3,5-dimethylbenzene
InChI:
InChI=1S/C11H13Br/c1-8-4-9(2)6-11(5-8)7-10(3)12/h4-6H,3,7H2,1-2H3
InChI Key:
BWKPJRJSQAVPIA-UHFFFAOYSA-N
SMILES:
BrC(=C)Cc1cc(C)cc(c1)C
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.129g/mol
Monoisotopic Mass:
224.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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