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2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid structure
Fine Chemical

2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid

TL;DR: 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid (CAS 1005087-90-0) is a chemical compound with molecular formula C17H27NO4 and molecular weight 309.194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Also Known As: 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid, 3-{[(3,3,5-trimethylcyclohexyl)amino]carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-((3,3,5-Trimethylcyclohexyl)carbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[N-(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-2-carbox ylic acid

CAS Number
1005087-90-0
Molecular Formula
C17H27NO4
Molecular Weight
309.194 g/mol
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Technical Specifications

Molecular FormulaC17H27NO4
Molecular Weight309.194 g/mol
XLogP2.4
Topological Polar Surface Area (TPSA)75.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass309.194 Da
Heavy Atoms22
Complexity475.0
SMILESCC1CC(CC(C1)(C)C)NC(=O)C2C3CCC(C2C(=O)O)O3
InChIKeyGDYZQHMAUYZCAF-UHFFFAOYSA-N

Chemical Property Profile of 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid

XLogP
2.4
TPSA (Topological Polar Surface Area)
75.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
22
Complexity
475.0
Exact Mass
309.194
Monoisotopic Mass
309.194
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 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid

The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid. Following Lipinski's Rule of Five, 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic 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 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid?

The CAS number of 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid is 1005087-90-0.

What is the molecular formula of 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid?

The molecular formula of 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid is C17H27NO4.

What is the molecular weight of 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid?

The molecular weight of 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid is 309.194 g/mol.

Where can I buy 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid?

You can request a quote for 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid?

Yes, CoreyChem provides custom synthesis services for 2-[(3,3,5-trimethylcyclohexyl)carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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