2-Aminoheptanoic acid

Base Information

• Chemical Name: 2-Aminoheptanoic acid
• CAS No.: 1115-90-8
• Molecular Formula: C7H15NO2
• Molecular Weight: 145.20
• Hs Code.: 2922499990
• NSC Number: 206253,20146
• DSSTox Substance ID: DTXSID401035690
• Nikkaji Number: J1.270.645F
• Wikidata: Q27133207
• Metabolomics Workbench ID: 1848
• Mol file: 1115-90-8.mol

Synonyms:2-Aminoheptanoic acid;1115-90-8;dl-2-aminoheptanoic acid;2-amino-heptanoic acid;DL-Homonorleucine;(1)-2-Aminoheptanoic acid;alpha-DL-Aminoheptanoic acid;S-2-Aminoheptanoic acid;Heptanoic acid, 2-amino-, DL-;2-Aminoenanthic acid;Heptanoic acid, 2-amino-, (1)-;N-amylglycine;aminoheptanoic acid;NSC20146;2-Aminoheptanoicacid;2-azanylheptanoic acid;alpha-aminoenanthic acid;SCHEMBL38735;(+-)-2-Aminoheptanoic acid;CHEBI:64304;DTXSID401035690;LMFA01100015;MFCD00136760;NSC-20146;NSC206253;AKOS000195082;AKOS016843172;AB88435;AB89095;CS-W016364;NSC-206253;DS-18375;2-Aminoheptanoic acid, >=97.0% (NT);FT-0633340;FT-0698423;C71385;EN300-1264470;A802387;A802431;Q27133207

Chemical Property of 2-Aminoheptanoic acid

Chemical Property:

• Vapor Pressure: 0.00664mmHg at 25°C
• Melting Point: 280 °C (dec.)
• Refractive Index: 1.465
• Boiling Point: 250.954 °C at 760 mmHg
• PKA: 2.55±0.24(Predicted)
• Flash Point: 105.574 °C
• PSA: 63.32000
• Density: 1.017 g/cm³
• LogP: 1.67890
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: -1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 145.110278721
• Heavy Atom Count: 10
• Complexity: 104

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Aminoheptanoic acid ≥97.0% (NT) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(C(=O)O)N

Technology Process of 2-Aminoheptanoic acid

There total 27 articles about 2-Aminoheptanoic 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:

2-oxoheptanoic acid (13088-48-7) → 2-aminoheptanoic acid (1115-90-8)

Guidance literature:

2-oxoheptanoic acid; With salicylamide; In toluene; at 20 ℃; for 3h;

With tetra-(n-butyl)ammonium iodide; In toluene; for 12h;

Reference yield:

α-chloroenanthic acid (20563-94-4) → 2-aminoheptanoic acid (1115-90-8)

Guidance literature:

With ammonia; In acetonitrile; at 100 ℃; for 2h;

DOI:10.1021/acs.orglett.6b02699

Reference yield:

acetylamino-pentyl-malonic acid diethyl ester (5440-46-0) → 2-aminoheptanoic acid (1115-90-8)

Guidance literature:

With hydrogenchloride;

upstream raw materials:

acetylamino-pentyl-malonic acid diethyl ester

2-n-pentyl malonic acid

amino-(5-methyl-[2]thienyl)-acetic acid

1-Bromopentane

Downstream raw materials:

2-benzoylamino-heptanoic acid

(R)-2-aminoheptanoic acid

(2S)-2-aminoheptanoic acid

2-Benzyloxycarbonylamino-heptanoic acid 2,2,2-trifluoro-ethyl ester

Refernces

• 1、 Van Hest, Jan C. M.,Kiick, Kristi L.,Tirrell, David A.. "Efficient incorporation of unsaturated methionine analogues into proteins in vivo". . p. 1282 - 1288. Retrieved 2000.
• 2、 -. "Amino acid stannous and application thereof in polyurethane foam". . . Retrieved 2021/11/27.