110698-30-1 | 3-(n-Pentyloxy)benzoic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$139.00	$97.00
5g	98%	in stock	$449.00	$315.00
10g	98%	in stock	$760.00	$532.00
25g	98%	in stock	$1,505.00	$1,054.00

Description

• Catalog Number: AI08193
• Chemical Name: 3-(n-Pentyloxy)benzoic acid
• CAS Number: 110698-30-1
• Molecular Formula: C12H16O3
• Molecular Weight: 208.2536
• MDL Number: MFCD06801156
• SMILES: CCCCCOc1cccc(c1)C(=O)O

Computed Properties

• Complexity: 191
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 6
• XLogP3: 3.5

Upstream Synthesis Route

Benzoic acid, 3-(pentyloxy)- is a versatile chemical compound commonly used in organic synthesis for the creation of various products. Due to its unique structure, this compound serves as a key building block in the development of pharmaceuticals, agrochemicals, and specialty chemicals. In chemical synthesis, Benzoic acid, 3-(pentyloxy)- can be utilized as a precursor in the production of esters, amides, and other organic compounds through processes such as esterification or amidation. Its pentyloxy group provides enhanced reactivity and functionality, allowing for efficient modification and derivatization in the synthesis of complex molecules. Additionally, Benzoic acid, 3-(pentyloxy)- can be employed as a stabilizing agent or catalyst in various reactions, contributing to the overall efficiency and selectivity of the synthetic pathway.