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1,4-didodecyl-2,5-diiodobenzene

1,4-didodecyl-2,5-diiodobenzene

CAS: 162715-93-7

Formula: C30H52I2

SMILES: CCCCCCCCCCCCC1=CC(I)=C(CCCCCCCCCCCC)C=C1I

IUPAC: 1,4-didodecyl-2,5-diiodobenzene

InChI: InChI=1S/C30H52I2/c1-3-5-7-9-11-13-15-17-19-21-23-27-25-30(32)28(26-29(27)31)24-22-20-18-16-14-12-10-8-6-4-2/h25-26H,3-24H2,1-2H3

Composition: C (54.06%), H (7.86%), I (38.08%)

Molar Mass: 666.555

Atom Count: 84

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 666.21584
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey BONMOXZHNZXHRN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 164.09
Topological Polar Surface Area 0
Polarizability 64.27
Ring Count 1
Rotatable Bond Count 22

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