2,4-Dihydroxy-3,3-dimethylbutanamide

Base Information

• Chemical Name: 2,4-Dihydroxy-3,3-dimethylbutanamide
• CAS No.: 4417-86-1
• Molecular Formula: C6H13NO3
• Molecular Weight: 147.174
• Hs Code.: 2924199090
• DSSTox Substance ID: DTXSID10377336
• Nikkaji Number: J2.032.979C
• Mol file: 4417-86-1.mol

Synonyms:2,4-dihydroxy-3,3-dimethylbutanamide;4417-86-1;SCHEMBL5329840;DTXSID10377336;MFCD00825730;AKOS005070918;SB84914;CS-0364947;FT-0635281;6R-0249;A872581;J-507223

Chemical Property of 2,4-Dihydroxy-3,3-dimethylbutanamide

Chemical Property:

• Vapor Pressure: 1.35E-07mmHg at 25°C
• Melting Point: 126-128oC
• Boiling Point: 387.3°Cat760mmHg
• Flash Point: 188°C
• PSA: 83.55000
• Density: 1.188g/cm³
• LogP: -0.44860
• XLogP3: -1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 147.08954328
• Heavy Atom Count: 10
• Complexity: 133

Purity/Quality:

97% ^*data from raw suppliers

2,4-Dihydroxy-3,3-dimethylbutanamide 95% ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CO)C(C(=O)N)O

Technology Process of 2,4-Dihydroxy-3,3-dimethylbutanamide

There total 10 articles about 2,4-Dihydroxy-3,3-dimethylbutanamide 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: 100.0%

pantolactone (79-50-5) → (R,S)-2,4-Dihydroxy-3,3-dimethylbutyramide (4417-86-1)

Guidance literature:

With ammonia; at -60 - 20 ℃;

DOI:10.1055/s-2000-6403

Reference yield:

→ (R,S)-2,4-Dihydroxy-3,3-dimethylbutyramide (4417-86-1)

Guidance literature:

With ammonia; water;

DOI:10.1021/ja01585a035

Reference yield:

pantolactone (79-50-5) → (R,S)-2,4-Dihydroxy-3,3-dimethylbutyramide (4417-86-1) + DL-4-amino-2-hydroxy-3,3-dimethylbutanoic acid lactam (70006-38-1)

Guidance literature:

With ammonia; toluene-4-sulfonic acid; In methanol; at 250 ℃; for 4h; under 7220 - 11400 Torr; Heating;

DOI:10.1016/S0040-4020(03)00156-X

upstream raw materials:

pantolactone

methanol

ammonia

water

Downstream raw materials:

(R,S)-2-Hydroxy-3,3-dimethyl-4-trityloxybutyramide

DL-4-amino-2-hydroxy-3,3-dimethylbutanoic acid lactam

pantolactone

rac-3-hydroxy-4,4-dimethyl-1-phenyl-2-pyrrolidinone