Pentyl chloroformate

Base Information Edit

Chemical Name:Pentyl chloroformate
CAS No.:638-41-5
Molecular Formula:C6H11ClO2
Molecular Weight:150.605
Hs Code.:29159000
European Community (EC) Number:211-336-4
NSC Number:7913
UNII:UF9VZ2UV69
DSSTox Substance ID:DTXSID0060933
Nikkaji Number:J122.123J
Wikidata:Q65224146
Mol file:638-41-5.mol

Synonyms:Pentyl chloroformate;638-41-5;Amyl chloroformate;Chloroformic acid amyl ester;pentyl carbonochloridate;n-pentyl chloroformate;Carbonochloridic acid, pentyl ester;Chloroformic Acid n-Amyl Ester;Formic acid, chloro-, pentyl ester;UF9VZ2UV69;Chloroformic Acid Pentyl Ester;carbonochloridic acid pentyl ester;NSC 7913;NSC-7913;EINECS 211-336-4;n-pentylchloroformate;Amyl=chloroformate;n-PCF;pentyl carbonochloridoate;Pentyl chloridocarbonate #;N-Pentyl chloroformate (n-Amyl Chloroformate);UNII-UF9VZ2UV69;SCHEMBL97024;chloroformic acid n-pentyl ester;DTXSID0060933;NSC7913;Pentyl chloridocarbonate, AldrichCPR;MFCD00058933;AKOS006230581;AS-10930;C0587;FT-0654430;D89273;EN300-1716862;SR-01000944789;SR-01000944789-1;Q65224146;4-(1H-BENZOIMIDAZOL-2-YL)-PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTER

Suppliers and Price of Pentyl chloroformate

Supply Marketing:Edit

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
n-Pentyl Chloroformate
5g
$ 312.00

TRC
n-PentylChloroformate
5g
$ 55.00

TRC
n-PentylChloroformate
50g
$ 140.00

TCI Chemical
Amyl Chloroformate >97.0%(GC)(T)
25g
$ 176.00

SynQuest Laboratories
Pentyl chloroformate 99%
25 g
$ 85.00

SynQuest Laboratories
Pentyl chloroformate 99%
5 g
$ 25.00

Medical Isotopes, Inc.
n-Pentyl-d11chloroformate
25 mg
$ 675.00

Medical Isotopes, Inc.
n-Pentyl-d11chloroformate
100 mg
$ 1025.00

American Custom Chemicals Corporation
N-PENTYL CHLOROFORMATE 95.00%
10G
$ 1175.35

American Custom Chemicals Corporation
N-PENTYL CHLOROFORMATE 95.00%
5G
$ 836.87

Total 121 raw suppliers

Chemical Property of Pentyl chloroformate Edit

Chemical Property:

Vapor Pressure:1.92mmHg at 25°C
Refractive Index:1.425
Boiling Point:164.9 °C at 760 mmHg
Flash Point:47.7 °C
PSA：26.30000
Density:1.057 g/cm³
LogP:2.55200
Storage Temp.:Refrigerator
Solubility.:Chloroform, Ethyl Acetate
Water Solubility.:1.213g/L at 25℃
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:150.0447573
Heavy Atom Count:9
Complexity:83.1

Purity/Quality:

98% ^*data from raw suppliers

n-Pentyl Chloroformate ^*data from reagent suppliers

Safty Information:

Pictogram(s): C
Hazard Codes:C
Statements: 10-23-34
Safety Statements: 26-36-45-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCOC(=O)Cl
Uses n-Pentyl Chloroformate is a chemical reagent used in the synthesis of intermediates for Capecitabine (C175650), an antineoplastic agent. As well as used for the synthesis of other pharmaceuticals such as dabigatran etexilate (D100150), a direct thrombin inhibitor.

Technology Process of Pentyl chloroformate

There total 3 articles about Pentyl chloroformate 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: 85.6%