2-Chloropropionamide

Base Information

• Chemical Name: 2-Chloropropionamide
• CAS No.: 27816-36-0
• Molecular Formula: C3H6ClNO
• Molecular Weight: 107.54
• Hs Code.: 29241900
• European Community (EC) Number: 248-671-0
• NSC Number: 401805,401803
• DSSTox Substance ID: DTXSID80950493
• Nikkaji Number: J27.707J
• Mol file: 27816-36-0.mol

Synonyms:2-chloropropanamide;2-chloropropionamide;2CPA-amide

Chemical Property of 2-Chloropropionamide

Chemical Property:

• Appearance/Colour: White to beige crystalline powder
• Vapor Pressure: 0.0392mmHg at 25°C
• Melting Point: 77-81 °C(lit.)
• Refractive Index: 1.449
• Boiling Point: 239.845 °C at 760 mmHg
• PKA: 14.69±0.50(Predicted)
• Flash Point: 98.855 °C
• PSA: 43.09000
• Density: 1.186g/cm³
• LogP: 0.79930
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 107.0137915
• Heavy Atom Count: 6
• Complexity: 63.8

Purity/Quality:

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

2-chloropropanamide ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)N)Cl

Technology Process of 2-Chloropropionamide

There total 8 articles about 2-Chloropropionamide 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: 82.0%

2-chloropropionyl chloride (7623-09-8) → 2-Chloropropionamide (27816-36-0)

Guidance literature:

With ammonia; In tetrahydrofuran; at -78 ℃; for 2h;

Reference yield: 19.0%

→ diethyl 2-amino-6-{[(3-amino-3-oxo)-2-propoxycarbamoyl]-methyl}-azulene-1,3-dicarboxylate + 2-Chloropropionamide (27816-36-0)

Guidance literature:

Reference yield: 8.0%

2-chlorpropionitrile (1617-17-0,70886-58-7) → 2-Chloropropionamide (27816-36-0) + (R,S)-2-chloropropionic acid (598-78-7)

Guidance literature:

at 30 ℃; for 1.5h; Rhodococcus sp. (SP 361), pH 7;

DOI:10.1016/S0957-4166(00)80215-3

upstream raw materials:

2-chloro-propanoic acid, ethyl ester

2-chlorpropionitrile

(R,S)-2-chloropropionic acid

2-chloro-propionimidoyl chloride

Downstream raw materials:

1-bromo-1-chloroethane

2-chlorpropionitrile

N-phenyl-2-(phenylamino)propanamide

2-(phenylamino)propanamide