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864512-85-6 | 2-Bromo-6-phenyl-1-hexene
CAS No: 864512-85-6 Catalog No: AG01EXWV MDL No:
Product Description
Catalog Number:
AG01EXWV
Chemical Name:
2-Bromo-6-phenyl-1-hexene
CAS Number:
864512-85-6
Molecular Formula:
C12H15Br
Molecular Weight:
239.1515
IUPAC Name:
5-bromohex-5-enylbenzene
InChI:
InChI=1S/C12H15Br/c1-11(13)7-5-6-10-12-8-3-2-4-9-12/h2-4,8-9H,1,5-7,10H2
InChI Key:
NQBGHNWGJRTYCI-UHFFFAOYSA-N
SMILES:
BrC(=C)CCCCc1ccccc1
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.156g/mol
Monoisotopic Mass:
238.036g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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