Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Feed Grade Proteins  /  Pharmaceutical Intermediates  /  Others  /  Cardiovascular Agents  /  Pharmaceutical
1,3-Pentanedione, 1-(2,4-dimethoxy-6-methylphenyl)- structure
1,3-Pentanedione, 1-(2,4-dimethoxy-6-methylphenyl)- structure

1,3-Pentanedione, 1-(2,4-dimethoxy-6-methylphenyl)-

Iupac Name:(9Z,12Z)-octadeca-9,12-dienoic acid
CAS No.:60-33-3
Molecular Weight:280.44548
1. Names and Identifiers
1.1 Name
1,3-Pentanedione, 1-(2,4-dimethoxy-6-methylphenyl)-
1.2 Synonyms

1-(2,4-Dimethoxy-6-methylphenyl)pentane-1,3-dione 1,3-Pentanedione, 1-(2,4-dimethoxy-6-methylphenyl)- 62036-47-9 CTK2C8348 DTXSID90493689

1.3 CAS No.
60-33-3
1.4 CID
5280450
1.5 Molecular Formula
C34H36N4O14S2·2NA (isomer)
1.6 Inchi
InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
1.7 InChkey
OYHQOLUKZRVURQ-HZJYTTRNSA-N
1.8 Canonical Smiles
CCCCCC=CCC=CCCCCCCCC(=O)O
1.9 Isomers Smiles
CCCCC/C=C\C/C=C\CCCCCCCC(=O)O
2. 3D Conformer
3. Properties
3.1 Melting Point
-5℃
3.2 Vapour
8.68e-07 mmHg
3.3 Refractive Index
1.4687-1.4707
4. Safety and Handling
4.1 Risk Statements
R36
4.2 Safety Statements
S24/25
4.3 Hazard Note
H225; H319
5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

6. Computational chemical data
  • Molecular Weight:280.44548g/mol
  • Molecular Formula:C34H36N4O14S2·2NA
  • XLogP3-AA:6.8
  • Exact Mass:280.24023
  • Monoisotopic Mass:280.24023
  • Complexity:267
  • Rotatable Bond Count:14
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:37.3
  • Heavy Atom Count:20
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:2
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
8. Question & Answer
  • The effects of linoleic acid on the human body are largely dependent on genes, a new study from the University of Eastern Finland shows. Linoleic acid is an essential fatty acid. People carrying different variants of the FADS1 gene had a different inflammatory response and different changes in thei...
  • A Japanese research group has demonstrated that 10-hydroxy-cis-12-octadecenoic acid (HYA), a gut microbial metabolite of linoleic acid, has a suppressive effect on intestinal inflammation. HYA is expected to be practically applied as a functional food. Inflammatory bowel diseases (IBDs), including ...
9. Recommended Suppliers
Global204SuppliersView all >>
  • Products:API
  • Tel:0086-27-59207850
  • Email:info@fortunachem.com
High quality Linoleic Acid CAS# 60-33-3 supplied by manufacturer
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 10 USD/Gram
  • Time: 2021/08/13
Inquire
  • Products:Cosmetic Raw Materials,solvents,etc.
  • Tel:86-311-66562153
  • Email:breeduan@crovellbio.com
Factory supply linoleic acid Cas 60-33-3 from China
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 10 USD/Kilogram
  • Time: 2021/07/06
Inquire
  • Products:Manufacture & Supply Biopharm Chemical, Specialty Chemical, PetroChemical.
  • Tel:86-592-8883942
  • Email:sale@amitychem.com
Factory Supply Linoleic Acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 0.1 USD/Kilogram
  • Time: 2021/03/09
Inquire
  • Products:Chemical products
  • Tel:86-571-88938639
  • Email:sales-gc@chinadayangchem.com
Linoleic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 2 USD/Kilogram
  • Time: 2019/12/20
Inquire
  • Products:API,Pharmaceutical intermediates, food additives, plant extracts,cosmetics,fine chemicals,reagents
  • Tel:+86-571-88216897
  • Email:bobtang@hzclap.com
Linoleic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/Gram
  • Time: 2021/01/23
Inquire