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2-tert-butyl-4-iodoaniline

2-tert-butyl-4-iodoaniline

CAS: 881057-14-3

Formula: C10H14IN

SMILES: CC(C)(C)C1=C(N)C=CC(I)=C1

IUPAC: 2-tert-butyl-4-iodoaniline

InChI: InChI=1S/C10H14IN/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6H,12H2,1-3H3

Composition: C (43.66%), H (5.13%), I (46.12%), N (5.09%)

Molar Mass: 275.133

Atom Count: 26

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 275.01709
Formal Charge 0
FSP3 0.4
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey CLQKQJQWOHPTSF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.79
Topological Polar Surface Area 26.02
Polarizability 23.79
Ring Count 1
Rotatable Bond Count 1

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Purity (%)
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Chemcia Scientific, LLC
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 881057-14-3 $241.50-$1,794.00$241.50$339.25$1,104.00$1,794.00
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