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2294-43-1 | Benzene, 1-bromo-4-(2-propen-1-yl)-
CAS No: 2294-43-1 Catalog No: AG002LLN MDL No:MFCD01319542
Product Description
Catalog Number:
AG002LLN
Chemical Name:
Benzene, 1-bromo-4-(2-propen-1-yl)-
CAS Number:
2294-43-1
Molecular Formula:
C9H9Br
Molecular Weight:
197.0718
MDL Number:
MFCD01319542
IUPAC Name:
1-bromo-4-prop-2-enylbenzene
InChI:
InChI=1S/C9H9Br/c1-2-3-8-4-6-9(10)7-5-8/h2,4-7H,1,3H2
InChI Key:
LIGHOIDTGDLAKK-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(cc1)Br
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.989g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.075g/mol
Monoisotopic Mass:
195.989g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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