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817642-34-5 | 1,3-Pentadiene, 1-iodo-2,4-dimethyl-, (1Z)-
CAS No: 817642-34-5 Catalog No: AG0050RE MDL No:
Product Description
Catalog Number:
AG0050RE
Chemical Name:
1,3-Pentadiene, 1-iodo-2,4-dimethyl-, (1Z)-
CAS Number:
817642-34-5
Molecular Formula:
C7H11I
Molecular Weight:
222.0667
IUPAC Name:
1-iodo-2,4-dimethylpenta-1,3-diene
InChI:
InChI=1S/C7H11I/c1-6(2)4-7(3)5-8/h4-5H,1-3H3
InChI Key:
XNYRNSNTTBOWKU-UHFFFAOYSA-N
SMILES:
I/C=C(\C=C(C)C)/C
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.991g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.069g/mol
Monoisotopic Mass:
221.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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