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3-amino-4-(4-iodophenyl)butanoic acid hydrochloride

3-amino-4-(4-iodophenyl)butanoic acid hydrochloride

Formula: C10H13ClINO2

SMILES: Cl.NC(CC(O)=O)CC1=CC=C(I)C=C1

IUPAC: 3-amino-4-(4-iodophenyl)butanoic acid hydrochloride

InChI: InChI=1/C10H12INO2.ClH/c11-8-3-1-7(2-4-8)5-9(12)6-10(13)14;/h1-4,9H,5-6,12H2,(H,13,14);1H

Composition: C (35.16%), H (3.84%), Cl (10.38%), I (37.15%), N (4.10%), O (9.37%)

Molar Mass: 341.57

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 340.96795
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey OEKGKNIRLMPHEI-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.1
Topological Polar Surface Area 63.32
Polarizability 24.91
Ring Count 1
Rotatable Bond Count 4

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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C10H13ClINO2 Quote Only
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