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3-Amino-4-propoxybenzoic acid structure
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3-Amino-4-propoxybenzoic acid

TL;DR: 3-Amino-4-propoxybenzoic acid (CAS 59691-15-5) is a chemical compound with molecular formula C10H13NO3 and molecular weight 195.08954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-amino-4-propoxybenzoic acid

Also Known As: 3-Amino-4-propoxybenzoic acid, Proparacaine Impurity 6, Proparacaine Impurity 8, Proparacaine Impurity 5, 3-amino-4-propoxy-Benzoic acid

CAS Number
59691-15-5
Molecular Formula
C10H13NO3
Molecular Weight
195.08954 g/mol
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Application Areas

Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Heterocyclic Building Blocks (1 patents) Organic Building Blocks (2 patents) Pharmaceutical Intermediates (40 patents)

Technical Specifications

Molecular FormulaC10H13NO3
Molecular Weight195.08954 g/mol
XLogP1.5
Topological Polar Surface Area (TPSA)72.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds4
Exact Mass195.08954 Da
Heavy Atoms14
Complexity196.0
SMILESCCCOC1=C(C=C(C=C1)C(=O)O)N
InChIKeyUZOZIVWRRZWJMT-UHFFFAOYSA-N

Chemical Property Profile of 3-Amino-4-propoxybenzoic acid

XLogP
1.5
TPSA (Topological Polar Surface Area)
72.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
14
Complexity
196.0
Exact Mass
195.08954
Monoisotopic Mass
195.08954
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-Amino-4-propoxybenzoic acid

The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-4-propoxybenzoic acid. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-4-propoxybenzoic acid. Following Lipinski's Rule of Five, 3-Amino-4-propoxybenzoic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-Amino-4-propoxybenzoic acid?

The CAS number of 3-Amino-4-propoxybenzoic acid is 59691-15-5.

What is the molecular formula of 3-Amino-4-propoxybenzoic acid?

The molecular formula of 3-Amino-4-propoxybenzoic acid is C10H13NO3.

What is the molecular weight of 3-Amino-4-propoxybenzoic acid?

The molecular weight of 3-Amino-4-propoxybenzoic acid is 195.08954 g/mol.

Where can I buy 3-Amino-4-propoxybenzoic acid?

You can request a quote for 3-Amino-4-propoxybenzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-Amino-4-propoxybenzoic acid?

Yes, CoreyChem provides custom synthesis services for 3-Amino-4-propoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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