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methyl 4-(iodomethyl)bicyclo[2.2.2]octane-1-carboxylate

methyl 4-(iodomethyl)bicyclo[2.2.2]octane-1-carboxylate

CAS: 1561865-37-9

Formula: C11H17IO2

SMILES: COC(=O)C12CCC(CI)(CC1)CC2

IUPAC: methyl 4-(iodomethyl)bicyclo[2.2.2]octane-1-carboxylate

InChI: InChI=1S/C11H17IO2/c1-14-9(13)11-5-2-10(8-12,3-6-11)4-7-11/h2-8H2,1H3

Composition: C (42.87%), H (5.56%), I (41.18%), O (10.38%)

Molar Mass: 308.159

Atom Count: 31

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 308.02732
Formal Charge 0
FSP3 0.91
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey OACWKAPHWJNCAX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.4
Topological Polar Surface Area 26.3
Polarizability 25.34
Ring Count 2
Rotatable Bond Count 3

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97% <5 Days 1561865-37-9 $220.68-$607.80$220.68$353.08$607.80
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