(S)-(+)-N-[1-(1-Naphthyl)ethyl]phthalamic acid

Base Information

• Chemical Name: (S)-(+)-N-[1-(1-Naphthyl)ethyl]phthalamic acid
• CAS No.: 163438-06-0
• Molecular Formula: C₂₀H₁₇NO₃
• Molecular Weight: 319.36
• Hs Code.: 2924299090
• European Community (EC) Number: 630-624-4
• DSSTox Substance ID: DTXSID70357477
• Wikidata: Q82137397
• Mol file: 163438-06-0.mol

Synonyms:(S)-(+)-N-[1-(1-Naphthyl)ethyl]phthalamic acid;163438-06-0;2-[[(1S)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid;SCHEMBL1286005;DTXSID70357477;(S)-2-((1-(Naphthalen-1-yl)ethyl)carbamoyl)benzoic acid;2-({[(1S)-1-(1-naphthyl)ethyl]amino}carbonyl)benzoic acid;2-{[(1S)-1-(NAPHTHALEN-1-YL)ETHYL]CARBAMOYL}BENZOIC ACID

Chemical Property of (S)-(+)-N-[1-(1-Naphthyl)ethyl]phthalamic acid

Chemical Property:

• Vapor Pressure: 2.18E-14mmHg at 25°C
• Melting Point: 167 °C (dec.)(lit.)
• Refractive Index: 1.658
• Boiling Point: 582°Cat760mmHg
• PKA: 3.48±0.36(Predicted)
• Flash Point: 305.8°C
• PSA: 69.89000
• Density: 1.255g/cm³
• LogP: 4.60380
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 319.12084340
• Heavy Atom Count: 24
• Complexity: 464

Purity/Quality:

98%min ^*data from raw suppliers

(S)-(+)-N-[1-(1-NAPHTHYL)ETHYL]PHTHALAMIC ACID Aldrich ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC=CC=C3C(=O)O
• Isomeric SMILES: C[C@@H](C1=CC=CC2=CC=CC=C21)NC(=O)C3=CC=CC=C3C(=O)O

Technology Process of (S)-(+)-N-[1-(1-Naphthyl)ethyl]phthalamic acid

There total 2 articles about (S)-(+)-N-[1-(1-Naphthyl)ethyl]phthalamic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

phthalic anhydride (85-44-9) + (S)-1-(1-Naphthyl)ethylamine (10420-89-0) → N-((S)-1-Naphthalen-1-yl-ethyl)-phthalamic acid (163438-06-0)

Guidance literature:

In tetrahydrofuran;

DOI:10.1016/0040-4020(96)00078-6

Reference yield:

phthalic anhydride (85-44-9) + (R)-1-(1-Naphthyl)ethylamine (3886-70-2) → N-[(R)-1-(1-naphthyl)ethyl]phthalamic acid (163438-05-9,163438-06-0)

Guidance literature:

In tetrahydrofuran;

DOI:10.1016/0040-4020(96)00078-6

upstream raw materials:

phthalic anhydride

(S)-1-(1-Naphthyl)ethylamine

(R)-1-(1-Naphthyl)ethylamine

Refernces