Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Pharmaceutical Intermediates  /  Pharmaceuticals and Biochemicals  /  Pharmaceutical  /  Others  /  Custom Manufacturing
2(3H)-Furanone, 3,4-dichloro-5-hydroxy- structure
2(3H)-Furanone, 3,4-dichloro-5-hydroxy- structure

2(3H)-Furanone, 3,4-dichloro-5-hydroxy-

Iupac Name:(E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
CAS No.:82571-53-7
Molecular Weight:228.251
1. Names and Identifiers
1.1 Name
2(3H)-Furanone, 3,4-dichloro-5-hydroxy-
1.2 CAS No.
82571-53-7
1.3 CID
5282440
1.4 Molecular Formula
C11H13NO2 (isomer)
1.5 Inchi
InChI=1S/C13H12N2O2/c16-13(17)6-5-11-1-3-12(4-2-11)9-15-8-7-14-10-15/h1-8,10H,9H2,(H,16,17)/b6-5+
1.6 InChkey
SHZKQBHERIJWAO-AATRIKPKSA-N
1.7 Canonical Smiles
C1=CC(=CC=C1CN2C=CN=C2)C=CC(=O)O
1.8 Isomers Smiles
C1=CC(=CC=C1CN2C=CN=C2)/C=C/C(=O)O
2. Properties
3.1 Density
1.44±0.1 g/cm3(Predicted)
3.1 Melting point
223 - 224
3.1 Refractive index
1.593
3.1 Precise Quality
228.09000
3.1 PSA
55.12000
3.1 logP
2.02920
3. Safety and Handling
4.1 Risk Statements
S36
4.1 Safety Statements
R22:Harmful if swallowed.
4.1 Packing Group
III
4.1 Hazard Class
6.1(b)
4.1 RIDADR
3249
4.1 WGK Germany
3
4.1 RTECS
US4025000
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

5. Computational chemical data
  • Molecular Weight:228.251g/mol
  • Molecular Formula:C11H13NO2
  • Compound Is Canonicalized:True
  • XLogP3-AA:
  • Exact Mass:228.089877630
  • Monoisotopic Mass:228.089877630
  • Complexity:283
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:55.1
  • Heavy Atom Count:17
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
6. Recommended Suppliers
Global204SuppliersView all >>
  • Products:xylazine hcl,phenacetin,4-Methylpropiophenone,(2-Bromoethyl)benzene,4-Methoxybenzoyl chloride
  • Tel:86-311-18033708384
  • Email:bella@hbyingong.com
thromboxane A2 synthesis inhibitor purity 99% cas 82571-53-7 Ozagrel in stock
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 75 USD/kilogram
  • Time: 2022/05/18
Inquire
  • Products:chemical raw materials, veterinary drug raw materials, animal and plant extracts, pharmaceutical excipients, pharmaceutical products, food additives
  • Tel:86-182-37818276
  • Email:hnkanbeichemical@126.com
Ozagrel
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2022/04/27
Inquire
  • Products:Chemical products, pharmaceutical intermediates, health food, fitness and muscle products research and development
  • Tel:86-000000-19932103556
  • Email:larissa@ylbosstech.com
High quality API Ozagrel CAS 82571-53-7 with best price
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2022/03/10
Inquire
  • Products:API
  • Tel:0086-27-59207850
  • Email:info@fortunachem.com
High quality Ozagrel Cas 82571-53-7 with best price and fast delivery
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2022/05/20
Inquire
  • Products:MK677, LGD4033 etc Sarms, HGH peptide,Nootropics,Tianeptine sodium, CBD oil, cannabidiol powder,Sildenafil Viagra powder, Tadalafil cialis powder, steroids etc
  • Tel:0086-311-15511698343
  • Email:anny@bsterltd.com
Ozagrel
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 0.01 USD/g
  • Time: 2022/05/19
Inquire