3-Methylpentyl butyrate

Base Information

Chemical Name:3-Methylpentyl butyrate
CAS No.:84254-83-1
Molecular Formula:C10H20 O2
Molecular Weight:172.268
Hs Code.:
European Community (EC) Number:282-528-3
UNII:WVY3Z4DBK3
DSSTox Substance ID:DTXSID501004511
Nikkaji Number:J297.573D
Mol file:84254-83-1.mol

Synonyms:3-Methylpentyl butyrate;3-methylpentyl butanoate;84254-83-1;EINECS 282-528-3;3-methyl pentyl butyrate;WVY3Z4DBK3;Butanoic acid 3-methylpentyl ester;DTXSID501004511;butanoic acid, 3-methylpentyl ester

Suppliers and Price of 3-Methylpentyl butyrate

Supply Marketing:

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

Total 3 raw suppliers

Chemical Property of 3-Methylpentyl butyrate

Chemical Property:

Vapor Pressure:0.413mmHg at 25°C
Melting Point:-78°C (estimate)
Refractive Index:1.3908 (estimate)
Boiling Point:195.7°C at 760 mmHg
Flash Point:71.4°C
PSA：26.30000
Density:0.872g/cm³
LogP:2.76590
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:172.146329876
Heavy Atom Count:12
Complexity:121

Purity/Quality:: 98%Min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(=O)OCCC(C)CC

Technology Process of 3-Methylpentyl butyrate

There total 5 articles about 3-Methylpentyl butyrate 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:

: 589-35-5,20281-83-8
3-methyl-1-pentanol

: 84254-83-1
3-methylpentyl butyrate

Guidance literature:: Multi-step reaction with 2 steps

1: Py

2: butyric acid

With pyridine; sodium butyrate;
DOI:10.1021/jo01067a038

Reference yield:

: 106-31-0
butanoic acid anhydride

: 35897-13-3
3-methyl-1-pentyl acetate

: 84254-83-1
3-methylpentyl butyrate

Guidance literature:: With sodium butyrate;
DOI:10.1021/jo01067a038

Reference yield:

: 137-32-6,616-16-0,1565-80-6,34713-94-5
(-)-2-Methylbutan-1-ol

: 84254-83-1
d-3-Methyl-pentyl-butyrat

Guidance literature:: Multi-step reaction with 3 steps

1: SOCl₂, Py / diethyl ether

2: (i) Mg, MeI, Et₂O, (ii) /BRN= 1209228/

3: butyric acid

With pyridine; thionyl chloride; sodium butyrate; In diethyl ether;
DOI:10.1021/jo01067a038