tert-Butyl 2-amino-5-iodobenzoate

Name: tert-Butyl 2-amino-5-iodobenzoate
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CAS No. 668261-27-6
Cat. No. CS-0145328
Molecule weight319.14
Purity95+%
MDL No.MFCD11112880

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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tert-Butyl 2-amino-5-iodobenzoate|CS-0145328

Structure of 668261-27-6

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General Information

CAS No. 668261-27-6
Cat. No. CS-0145328
Purity 95+%
MDL No. MFCD11112880
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₄INO₂
Molecular Weight 319.14
Synonym(s) 2-amino-5-iodobenzoic acid tert-butyl ester
SMILES O=C(OC(C)(C)C)C1=CC(I)=CC=C1N

Synthesis

Route1
- 64113-91-3
- ~85%
- 668261-27-6
References
- Li, Jianke; Wakefield, Brian D.; Ruble, J. Craig; Stiff, Cory M.; Romero, Donna L.; Marotti, Keith R.; Sweeney, Michael T.; Zurenko, Gary E.; Rohrer, Douglas C.; Thorarensen, Atli Bioorganic and Medicinal Chemistry Letters, 2007 , vol. 17, # 8 p. 2347 - 2350

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 52.32
LogP 2.8287
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Amine

Building Blocks Functional Group Iodide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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tert-Butyl 2-amino-5-iodobenzoate

CAS No. 668261-27-6

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