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(3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid structure
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(3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid

TL;DR: (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid (CAS 117391-53-4) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(3R)-3-amino-3-(4-propan-2-ylphenyl)propanoic acid

Also Known As: Bionet2_001361, (R)-b-Amino-4-(1-methylethyl)benzenepropanoic acid, 3-amino-3-(4-isopropylphenyl)propanoic acid, (3R)-3-AMINO-3-[4-(METHYLETHYL)PHENYL]PROPANOIC ACID, (3R)-3-azaniumyl-3-(4-isopropylphenyl)propanoate

CAS Number
117391-53-4
Molecular Formula
C12H17NO2
Molecular Weight
207.12593 g/mol
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Technical Specifications

Molecular FormulaC12H17NO2
Molecular Weight207.12593 g/mol
XLogP-0.2
Topological Polar Surface Area (TPSA)67.8 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass207.12593 Da
Heavy Atoms15
Complexity202.0
SMILESCC(C)C1=CC=C(C=C1)[C@@H](CC(=O)O)N
InChIKeyXRDCVKSGZNDEDT-LLVKDONJSA-N

Chemical Property Profile of (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid

XLogP
-0.2
TPSA (Topological Polar Surface Area)
67.8
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
15
Complexity
202.0
Exact Mass
207.12593
Monoisotopic Mass
207.12593
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 (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid

The XLogP value of -0.2 indicates that (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid. Following Lipinski's Rule of Five, (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic 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 (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid?

The CAS number of (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid is 117391-53-4.

What is the molecular formula of (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid?

The molecular formula of (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid is C12H17NO2.

What is the molecular weight of (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid?

The molecular weight of (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid is 207.12593 g/mol.

Where can I buy (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid?

You can request a quote for (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid?

Yes, CoreyChem provides custom synthesis services for (3R)-3-Amino-3-[4-(methylethyl)phenyl]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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