Cas no 6178-45-6 (Benzoic acid,3,4,5-trimethoxy-, propyl ester)
6178-45-6 structure
Product Name:Benzoic acid,3,4,5-trimethoxy-, propyl ester
Benzoic acid,3,4,5-trimethoxy-, propyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,3,4,5-trimethoxy-, propyl ester
- Propyl 3,4,5-trimethoxybenzoate
-
- Inchi： 1S/C13H18O5/c1-5-6-18-13(14)9-7-10(15-2)12(17-4)11(8-9)16-3/h7-8H,5-6H2,1-4H3
- InChI Key： FZUOVWLTJMRMHO-UHFFFAOYSA-N
- SMILES： O(C(C1C=C(C(=C(C=1)OC)OC)OC)=O)CCC
Computed Properties
- Exact Mass: 254.11544
- Monoisotopic Mass: 254.115
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 7
- Complexity: 242
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 54A^2
- XLogP3: 2.6
Experimental Properties
- Density: 1.094
- Boiling Point: 308.9°C at 760 mmHg
- Flash Point: 131.1°C
- Refractive Index: 1.491
- PSA: 53.99
Benzoic acid,3,4,5-trimethoxy-, propyl ester Related Literature
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
6178-45-6 (Benzoic acid,3,4,5-trimethoxy-, propyl ester) Related Products
- 1916-07-0(Methyl 3,4,5-trimethoxybenzoate)
- 6178-44-5(Ethyl 3,4,5-Trimethoxybenzoate)
- 3943-80-4(Ethyl 4-hydroxy-3,5-dimethoxybenzoate)
- 1719-88-6(3,4,5-Trimethoxybenzoic Anhydride)
- 3943-77-9(Ethyl 3,4-dimethoxybenzoate)
- 121-79-9(Propyl gallate)
- 617-05-0(Ethyl vanillate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
Recommended suppliers
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
鉅瀾化工科技(青島)有限公司
Gold Member
Audited Supplier
CN Supplier
Bulk
Wuhan ChemNorm Biotech Co.,Ltd.
Gold Member
Audited Supplier
CN Supplier
Reagent
PRIBOLAB PTE.LTD
Gold Member
Audited Supplier
CN Supplier
Reagent
Shanghai Hongxiang Biomedical Technology Co., Ltd.
Gold Member
Audited Supplier
CN Supplier
Bulk
