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2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid structure
Fine Chemical

2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid

TL;DR: 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid (CAS 1139908-81-8) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid

Also Known As: 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid, AF-399/25030001

CAS Number
1139908-81-8
Molecular Formula
C11H13NO2
Molecular Weight
191.09464 g/mol
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Technical Specifications

Molecular FormulaC11H13NO2
Molecular Weight191.09464 g/mol
XLogP-0.8
Topological Polar Surface Area (TPSA)56.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass191.09464 Da
Heavy Atoms14
Complexity212.0
SMILESC1CN[C@@H](C2=CC=CC=C21)CC(=O)O
InChIKeyBUAVPRGEIAVFBF-SNVBAGLBSA-N

Chemical Property Profile of 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid

XLogP
-0.8
TPSA (Topological Polar Surface Area)
56.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
14
Complexity
212.0
Exact Mass
191.09464
Monoisotopic Mass
191.09464
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-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid

The XLogP value of -0.8 indicates that 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.7 Ų, 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid has 1 hydrogen bond donor(s) and 2 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-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid?

The CAS number of 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid is 1139908-81-8.

What is the molecular formula of 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid?

The molecular formula of 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid is C11H13NO2.

What is the molecular weight of 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid?

The molecular weight of 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid is 191.09464 g/mol.

Where can I buy 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid?

You can request a quote for 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid?

Yes, CoreyChem provides custom synthesis services for 2-[(1R)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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