1-Phenyl-1-propen-2-OL benzoate

Base Information

Chemical Name:1-Phenyl-1-propen-2-OL benzoate
CAS No.:5351-09-7
Molecular Formula:C16H14 O2
Molecular Weight:238.2812
Hs Code.:
NSC Number:100
Nikkaji Number:J3.617.924D
Mol file:5351-09-7.mol

Synonyms:NSC100;NSC-100;1-PHENYL-1-PROPEN-2-OL BENZOATE;J3.617.924D;Benzoic acid (Z)-1-phenyl-1-propene-2-yl ester

Suppliers and Price of 1-Phenyl-1-propen-2-OL benzoate

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 4 raw suppliers

Chemical Property of 1-Phenyl-1-propen-2-OL benzoate

Chemical Property:

Vapor Pressure:1.81E-05mmHg at 25°C
Boiling Point:363.4°Cat760mmHg
Flash Point:152°C
Density:1.121g/cm³
XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:238.099379685
Heavy Atom Count:18
Complexity:294

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CC1=CC=CC=C1)OC(=O)C2=CC=CC=C2
Isomeric SMILES:C/C(=C/C1=CC=CC=C1)/OC(=O)C2=CC=CC=C2

Technology Process of 1-Phenyl-1-propen-2-OL benzoate

There total 4 articles about 1-Phenyl-1-propen-2-OL benzoate 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:

: 1197032-27-1
4-phenylprop-1-en-2-yl benzoate

: 5351-09-7
1-phenylprop-1-en-2-yl benzoate

Guidance literature:: With trifluorormethanesulfonic acid; In chloroform-d1; at 25 ℃; for 0.25h; Inert atmosphere;
DOI:10.1021/ol2012132

Reference yield:

: 10147-11-2
propargyl benzene

: 65-85-0,8013-63-6
benzoic acid

: 5351-09-7
1-phenylprop-1-en-2-yl benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; trifuran-2-yl-phosphane; sodium carbonate / toluene / 16 h / 60 °C

2: trifluorormethanesulfonic acid / chloroform-d1 / 0.25 h / 25 °C / Inert atmosphere

With [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂; trifuran-2-yl-phosphane; trifluorormethanesulfonic acid; sodium carbonate; In chloroform-d1; toluene;
DOI:10.1021/ol2012132

Reference yield:

: 673-32-5
1-Phenylprop-1-yne

: 65-85-0,8013-63-6
benzoic acid

: (E)-1-phenylprop-1-en-1-yl benzoate

: 5351-09-7
(E)-1-phenylprop-1-en-2-yl benzoate

Guidance literature:: With C₅₈H₃₄F₁₈O₆P₂Ru; tris(pentafluorophenyl)borate; acenaphthene; In toluene; at 140 ℃; for 8h; Overall yield = 97 %; Overall yield = 230 mg; Inert atmosphere;
DOI:10.1002/ejoc.201501583