Isopropyl formimidate hydrochloride

Base Information

• Chemical Name: Isopropyl formimidate hydrochloride
• CAS No.: 16694-44-3
• Molecular Formula: C4H9 N O . Cl H
• Molecular Weight: 123.58
• Hs Code.: 2925290090
• European Community (EC) Number: 803-062-4
• DSSTox Substance ID: DTXSID20510217
• Mol file: 16694-44-3.mol

Synonyms:Isopropyl formimidate hydrochloride;16694-44-3;propan-2-yl methanimidate;hydrochloride;SCHEMBL992219;DTXSID20510217;NWCBOWOTHFLANG-UHFFFAOYSA-N;Isopropyl formimidate hydrochloride, technical grade;J-010321;Propan-2-yl methanimidate--hydrogen chloride (1/1)

Chemical Property of Isopropyl formimidate hydrochloride

Chemical Property:

• Melting Point: 108 °C (dec.)(lit.)
• Boiling Point: 112.7°Cat760mmHg
• Flash Point: 21.9°C
• PSA: 33.08000
• Density: g/cm³
• LogP: 1.92020
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 123.0450916
• Heavy Atom Count: 7
• Complexity: 42.8

Purity/Quality:

99.90% ^*data from raw suppliers

Isopropyl formimidate hydrochloride technical grade ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)OC=N.Cl
• Uses: Isopropyl formimidate hydrochloride may be used in the synthesis of 5: 6-dimethyl-1-α-D-ribofuranosylbenziminazole.

Technology Process of Isopropyl formimidate hydrochloride

There total 1 articles about Isopropyl formimidate 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:

formamide (77287-34-4,77287-35-5,60100-09-6) + isopropyl alcohol (67-63-0,8013-70-5) → isopropyl formimidate hydrochloride (16694-44-3)

Guidance literature:

With benzoyl chloride; In diethyl ether; at 10 - 20 ℃; for 2.75h;

Reference yield: 75.0%

isopropyl formimidate hydrochloride (16694-44-3) + phenylacetyl chloride (103-80-0) → N-phenylacetyl isopropyl formimidate

Guidance literature:

With triethylamine; In dichloromethane; at -35 ℃;

DOI:10.1016/0040-4020(95)00657-T

Reference yield: 73.0%

isopropyl formimidate hydrochloride (16694-44-3) + hydrocinnamic acid chloride (645-45-4) → N-hydrocinnamoyl isopropyl formimidate

Guidance literature:

With triethylamine; In dichloromethane; at -35 ℃;

DOI:10.1016/0040-4020(95)00657-T

upstream raw materials:

formamide

isopropyl alcohol

Downstream raw materials:

N-(N'-p-nitrobenzyloxycarbonyl) formimidoyl cysteamine

N-{4-[2-(4-[(iminomethyl)amino]phenyl)ethyl]-1,3-thiazol-2-yl}acetamide

(R)-3-(2-(trans-4-formimidamidocyclohexyl)acetamido)-2-hydroxy-3,4-dihydro-2H-benzo[e][1,2]oxaborinine-8-carboxylic acid

(R)-3-(2-(trans-4-(4,5-dihydro-1H-imidazol-1-yl)cyclohexyl)acetamido)-2-hydroxy-3,4-dihydro-2H-benzo[e][1,2]oxaborinine-8-carboxylic acid

Refernces