Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Agrochemical Intermediates  /  Pharmaceutical Intermediates  /  Organic Intermediate  /  Agrochemicals  /  Other pesticide
FRG-00004 structure
FRG-00004 structure

FRG-00004

Iupac Name:(1R,3R)-3-[(Z)-2-chloro-3,3,3-trifluoroprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CAS No.:72748-35-7
Molecular Weight:242.62
1. Names and Identifiers
1.1 Name
FRG-00004
1.2 Synonyms

(3r,5s)-5-(3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl)pyrrolidin-3-ol AKOS026675043 GS-0102 KS-00003KUO MOLPORT-023-275-768 ZINC49587729

1.3 CAS No.
72748-35-7
1.4 CID
6440474
1.5 Molecular Formula
C21H26N2O2 (isomer)
1.6 Inchi
InChI=1S/C9H10ClF3O2/c1-8(2)4(6(8)7(14)15)3-5(10)9(11,12)13/h3-4,6H,1-2H3,(H,14,15)/b5-3-/t4-,6-/m0/s1
1.7 InChkey
SPVZAYWHHVLPBN-WREUKLMHSA-N
1.8 Canonical Smiles
CC1(C(C1C(=O)O)C=C(C(F)(F)F)Cl)C
1.9 Isomers Smiles
CC1([C@H]([C@H]1C(=O)O)/C=C(/C(F)(F)F)\Cl)C
2. Properties
3.1 Melting point
107-109°C
3.1 Refractive index
1.511
3.1 Precise Quality
242.03200
3.1 PSA
37.30000
3.1 logP
3.02820
3. 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

4. Computational chemical data
  • Molecular Weight:242.62g/mol
  • Molecular Formula:C21H26N2O2
  • Compound Is Canonicalized:True
  • XLogP3-AA:
  • Exact Mass:242.0321417
  • Monoisotopic Mass:242.0321417
  • Complexity:320
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:37.3
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:2
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
5. Recommended Suppliers
Global142SuppliersView all >>
  • Products:Pharmaceutical raw materials,Chemical reagent, Food aditives,Plant ExtracPharmaceutical and pesticide intermediates.
  • Tel:86-431-81915458
  • Email:cathytan@jltely.com
Cyclopropanecarboxylic acid,3-(2-chloro-3,3,3-trifluoro-1-propen-1-yl)-2,2-dimethyl-, (1R,3R)-rel-
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/gram
  • Time: 2022/05/27
Inquire
  • Products:biotechnology pharmaceutical intermediates biotechnology medical intermediates
  • Tel:0086-0310-15343106358
  • Email:guide@cnyouze.com
cis-Cyhalothric acid CAS.72748-35-7
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 37 USD/kg
  • Time: 2022/05/24
Inquire
  • Products:CBD,443998-65-0,16648-44-5,BMK,PMK
  • Tel:86-191-31911055
  • Email:admin@hbbocao.com
99% Lambda Cyhalothrin Acid with Factory Price CAS 72748-35-7
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 10 USD/kilogram
  • Time: 2022/05/10
Inquire
  • Products:Cosmetic Raw Materials,solvents,etc.
  • Tel:86-311-66562153
  • Email:breeduan@crovellbio.com
99% Lambda Cyhalothrin Acid with Factory Price CAS 72748-35-7
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 10 USD/kilogram
  • Time: 2022/05/05
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
Z-(1R,S)-cis-2,2-dimethyl-3-(2,2-chloro-3,3,3-trifluoro-1-propenyl)cyclopropanecarboxylic acid
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2022/04/27
Inquire