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87621-26-9 | Cyclohexane, 1-iodo-3,5-dimethyl-
CAS No: 87621-26-9 Catalog No: AG004P56 MDL No:MFCD20414903
Product Description
Catalog Number:
AG004P56
Chemical Name:
Cyclohexane, 1-iodo-3,5-dimethyl-
CAS Number:
87621-26-9
Molecular Formula:
C8H15I
Molecular Weight:
238.1092
MDL Number:
MFCD20414903
IUPAC Name:
1-iodo-3,5-dimethylcyclohexane
InChI:
InChI=1S/C8H15I/c1-6-3-7(2)5-8(9)4-6/h6-8H,3-5H2,1-2H3
InChI Key:
FPZYLPTUKVYLSA-UHFFFAOYSA-N
SMILES:
CC1CC(C)CC(C1)I
Properties
Complexity:
80.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.022g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.112g/mol
Monoisotopic Mass:
238.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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