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918959-10-1 | Benzene, 1-(3-iodo-1-propen-1-yl)-2-methyl-
CAS No: 918959-10-1 Catalog No: AG006LQT MDL No:
Product Description
Catalog Number:
AG006LQT
Chemical Name:
Benzene, 1-(3-iodo-1-propen-1-yl)-2-methyl-
CAS Number:
918959-10-1
Molecular Formula:
C10H11I
Molecular Weight:
258.0988
IUPAC Name:
1-(3-iodoprop-1-enyl)-2-methylbenzene
InChI:
InChI=1S/C10H11I/c1-9-5-2-3-6-10(9)7-4-8-11/h2-7H,8H2,1H3
InChI Key:
BCZDNQMEDWGKPT-UHFFFAOYSA-N
SMILES:
ICC=Cc1ccccc1C
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.991g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.102g/mol
Monoisotopic Mass:
257.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.9
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