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4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline structure
Fine Chemical

4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline

TL;DR: 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline (CAS 14277-97-5) is a chemical compound with molecular formula C15H21NO6 and molecular weight 311.1369 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-(6-carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)pyrrolidine-2-carboxylic acid

Also Known As: domoic acid, gabapentin, domoric acid, (-)-domoic acid, L-Domoic acid

CAS Number
14277-97-5
Molecular Formula
C15H21NO6
Molecular Weight
311.1369 g/mol
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Technical Specifications

Molecular FormulaC15H21NO6
Molecular Weight311.1369 g/mol
XLogP-1.3
Topological Polar Surface Area (TPSA)124.0 Ų
Hydrogen Bond Donors4
Hydrogen Bond Acceptors7
Rotatable Bonds7
Exact Mass311.1369 Da
Heavy Atoms22
Complexity510.0
SMILESCC(C=CC=C(C)C1CNC(C1CC(=O)O)C(=O)O)C(=O)O
InChIKeyVZFRNCSOCOPNDB-UHFFFAOYSA-N

Product Description

Applications: 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline (CAS 14277-97-5) has the molecular formula C15H21NO6 and a molecular weight of 311.14 g/mol. Synonyms include domoic acid and gabapentin.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline

XLogP
-1.3
TPSA (Topological Polar Surface Area)
124.0
Hydrogen Bond Donors
4
Hydrogen Bond Acceptors
7
Rotatable Bonds
7
Heavy Atoms
22
Complexity
510.0
Exact Mass
311.1369
Monoisotopic Mass
311.1369
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 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline

The XLogP value of -1.3 indicates that 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline. Following Lipinski's Rule of Five, 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline?

The CAS number of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline is 14277-97-5.

What is the molecular formula of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline?

The molecular formula of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline is C15H21NO6.

What is the molecular weight of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline?

The molecular weight of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline is 311.1369 g/mol.

What are the applications of 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline?

4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...

Where can I buy 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline?

You can request a quote for 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline?

Yes, CoreyChem provides custom synthesis services for 4-(6-Carboxyhepta-2,4-dien-2-yl)-3-(carboxymethyl)proline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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