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94137-73-2 | 1-IODO-4,4-DIMETHYL-PENTA-1,2-DIENE
CAS No: 94137-73-2 Catalog No: AG006QA5 MDL No:
Product Description
Catalog Number:
AG006QA5
Chemical Name:
1-IODO-4,4-DIMETHYL-PENTA-1,2-DIENE
CAS Number:
94137-73-2
Molecular Formula:
C7H11I
Molecular Weight:
222.0667
IUPAC Name:
1-iodo-4,4-dimethylpenta-1,2-diene
InChI:
InChI=1S/C7H11I/c1-7(2,3)5-4-6-8/h5-6H,1-3H3
InChI Key:
BBJRIIWDNVBCCJ-UHFFFAOYSA-N
SMILES:
IC=C=CC(C)(C)C
Properties
Complexity:
111
Compound Is Canonicalized:
No
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:
0
XLogP3:
2.9
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