2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
TL;DR: 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid (CAS 50714-69-7) is a chemical compound with molecular formula C16H21NO4 and molecular weight 291.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-dihydro-1H-naphthalene-2-carboxylic acid
Also Known As: 2-(BOC-AMINO)-1,2,3,4-TETRAHYDRONAPHTHALENE-2-CARBOXYLIC ACID, BOC-ATC-OH, N-boc-2-aminotetralin-2-carboxylic acid, 2-N-Boc-amino-tetrahydro-2-naphthoic acid, BOC-2-AMINOTETRALINE-2-CARBOXYLIC ACID
| Molecular Formula | C16H21NO4 |
|---|---|
| Molecular Weight | 291.15 g/mol |
| LogP | 2.5234 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.14706 |
| Heavy Atoms | 21 |
| Complexity | 561.64056 |
Chemical Identifiers
| CAS Number | 50714-69-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1(CCC2=CC=CC=C2C1)C(=O)O |
Product Overview
2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid (CAS 50714-69-7), with molecular formula C16H21NO4 and molecular weight 291.15 g/mol. IUPAC: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-dihydro-1H-naphthalene-2-carboxylic acid.
Chemical Property Profile of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
Property Insights of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid
The XLogP value of 2.5234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid. Following Lipinski's Rule of Five, 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid?
The CAS number of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid is 50714-69-7.
What is the molecular formula of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid?
The molecular formula of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid is C16H21NO4.
What is the molecular weight of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid?
The molecular weight of 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid is 291.15 g/mol.
Where can I buy 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid?
You can request a quote for 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Boc-amino)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.