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17909-72-7 | 1,6-Octadiene, 8-bromo-7-methyl-3-methylene-, (E)- (8CI,9CI)
CAS No: 17909-72-7 Catalog No: AG0026S8 MDL No:
Product Description
Catalog Number:
AG0026S8
Chemical Name:
1,6-Octadiene, 8-bromo-7-methyl-3-methylene-, (E)- (8CI,9CI)
CAS Number:
17909-72-7
Molecular Formula:
C10H15Br
Molecular Weight:
215.1301
IUPAC Name:
8-bromo-7-methyl-3-methylideneocta-1,6-diene
InChI:
InChI=1S/C10H15Br/c1-4-9(2)6-5-7-10(3)8-11/h4,7H,1-2,5-6,8H2,3H3
InChI Key:
LHKIOKHRMJAOCT-UHFFFAOYSA-N
SMILES:
BrC/C(=C/CCC(=C)C=C)/C
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.036g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.134g/mol
Monoisotopic Mass:
214.036g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.5
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