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824431-53-0 | Benzene, 1-[(1E)-5-iodo-1-pentenyl]-4-methyl-
CAS No: 824431-53-0 Catalog No: AG0059NC MDL No:
Product Description
Catalog Number:
AG0059NC
Chemical Name:
Benzene, 1-[(1E)-5-iodo-1-pentenyl]-4-methyl-
CAS Number:
824431-53-0
Molecular Formula:
C12H15I
Molecular Weight:
286.1520
IUPAC Name:
1-(5-iodopent-1-enyl)-4-methylbenzene
InChI:
InChI=1S/C12H15I/c1-11-6-8-12(9-7-11)5-3-2-4-10-13/h3,5-9H,2,4,10H2,1H3
InChI Key:
YLTRYAQIFCOZDT-UHFFFAOYSA-N
SMILES:
ICCC/C=C/c1ccc(cc1)C
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.022g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.156g/mol
Monoisotopic Mass:
286.022g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5
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