Methyl 4-amino-2-isopropoxybenzoate

Name: Methyl 4-amino-2-isopropoxybenzoate
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CAS No. 909563-22-0
Cat. No. CS-0059762
Purity≥98%
MDL No.MFCD24624427

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Methyl 4-amino-2-isopropoxybenzoate|CS-0059762

Structure of 909563-22-0

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Description

Methyl 4-amino-2-isopropoxybenzoate features a strategically positioned amino group and isopropoxy substituent on the aromatic ring, enabling enhanced solubility and tunable electronic properties. This compound serves as a key intermediate in the synthesis of bioactive molecules and functional materials, offering reliable stability under standard conditions.

Application

Methyl 4-amino-2-isopropoxybenzoate serves as a versatile building block in medicinal chemistry, enabling efficient access to substituted benzamides and heterocyclic scaffolds. Its ortho-isopropoxy group enhances regioselectivity in electrophilic substitution, while the amino and ester functionalities offer orthogonal handles for sequential derivatization. The compound exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthesis campaigns in API development.

General Information

CAS No. 909563-22-0
Cat. No. CS-0059762
Purity ≥98%
MDL No. MFCD24624427
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₅NO₃
Molecular Weight 209.24
Synonym(s) Benzoic acid, 4-amino-2-(1-methylethoxy)-, methyl ester
SMILES O=C(OC)C1=CC=C(N)C=C1OC(C)C

Computational Chemistry Data

TPSA 61.55
LogP 1.8426
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 3

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 4-amino-2-isopropoxybenzoate

CAS No. 909563-22-0

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