DL-2-Phenylglycine 6,6-dimethylheptyl ester hydrochloride

Base Information

• Chemical Name: DL-2-Phenylglycine 6,6-dimethylheptyl ester hydrochloride
• CAS No.: 87252-88-8
• Molecular Formula: C₁₇H₂₇NO₂*ClH
• Molecular Weight: 313.868
• DSSTox Substance ID: DTXSID001007441
• Mol file: 87252-88-8.mol

Synonyms:DL-2-Phenylglycine 6,6-dimethylheptyl ester hydrochloride;87252-88-8;Glycine, 2-phenyl-, 6,6-dimethylheptyl ester, hydrochloride, DL-;Benzeneacetic acid, alpha-amino-, 6,6-methylheptyl ester, hydrochloride, (+-)-;DTXSID001007441;LS-72819;6,6-Dimethylheptyl amino(phenyl)acetate--hydrogen chloride (1/1)

Chemical Property of DL-2-Phenylglycine 6,6-dimethylheptyl ester hydrochloride

Chemical Property:

• Vapor Pressure: 2E-05mmHg at 25°C
• Boiling Point: 361.9°C at 760 mmHg
• Flash Point: 204.4°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 313.1808568
• Heavy Atom Count: 21
• Complexity: 277

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)CCCCCOC(=O)C(C1=CC=CC=C1)N.Cl

Technology Process of DL-2-Phenylglycine 6,6-dimethylheptyl ester hydrochloride

There total 3 articles about DL-2-Phenylglycine 6,6-dimethylheptyl ester hydrochloride 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:

1-bromo-4,4-dimethylpentane (6570-95-2) → Amino-phenyl-acetic acid 6,6-dimethyl-heptyl ester; hydrochloride (87252-88-8)

Guidance literature:

Multi-step reaction with 4 steps

1: 70 percent / Na/C₂H₅OH / 6 h / Heating

3: 84 percent / LiAlH₄ / diethyl ether

4: 90 percent

With lithium aluminium tetrahydride; ethanol; sodium; In diethyl ether;

Reference yield:

4,4'-Dimethylpentylmalonsaeurediethylester (87253-07-4) → Amino-phenyl-acetic acid 6,6-dimethyl-heptyl ester; hydrochloride (87252-88-8)

Guidance literature:

Multi-step reaction with 3 steps

2: 84 percent / LiAlH₄ / diethyl ether

3: 90 percent

With lithium aluminium tetrahydride; In diethyl ether;

Reference yield:

6,6-Dimethyloenanthsaeure (15898-92-7) → Amino-phenyl-acetic acid 6,6-dimethyl-heptyl ester; hydrochloride (87252-88-8)

Guidance literature:

Multi-step reaction with 2 steps

1: 84 percent / LiAlH₄ / diethyl ether

2: 90 percent

With lithium aluminium tetrahydride; In diethyl ether;

upstream raw materials:

1-bromo-4,4-dimethylpentane

6,6-Dimethyloenanthsaeure

4,4'-Dimethylpentylmalonsaeurediethylester

Refernces