Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace
Encyclop..
  • Products
  • Encyclopedia
  • Buy offers
  • Suppliers
Home> Encyclopedia >   /  Organic Intermediate  /  Pharmaceutical Intermediates  /  Organic Intermediates  /  Pharmaceuticals and Biochemicals  /  Custom Manufacturing
T6905906 structure
T6905906 structure

T6905906

Iupac Name:(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1H-indol-3-yl)propanoic acid
CAS No.: 86123-11-7
Molecular Weight:426.472
Modify Date.: 2022-02-23 11:11
1. Names and Identifiers
1.1 Name
T6905906
1.2 Synonyms

5-methyl-5-(4-methylphenyl)-3-{[3-(2,2,2-trifluoroethoxy)phenyl]methyl}imidazolidine-2,4-dione MCULE-7767765665 MOLPORT-009-344-694 Z751067606

1.3 CAS No.
86123-11-7
1.4 CID
978344
1.5 Molecular Formula
C14H12N2O3 (isomer)
1.6 Inchi
InChI=1S/C26H22N2O4/c29-25(30)24(13-16-14-27-23-12-6-5-7-17(16)23)28-26(31)32-15-22-20-10-3-1-8-18(20)19-9-2-4-11-21(19)22/h1-12,14,22,24,27H,13,15H2,(H,28,31)(H,29,30)/t24-/m1/s1
1.7 InChkey
MGHMWKZOLAAOTD-XMMPIXPASA-N
1.8 Canonical Smiles
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O
1.9 Isomers Smiles
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CNC5=CC=CC=C54)C(=O)O
2. Properties
3.1 Melting point
182-185℃
3.1 Refractive index
29 ° (C=1, DMF)
3.1 Precise Quality
426.15800
3.1 PSA
91.42000
3.1 logP
5.09320
3. Safety and Handling
4.1 Safety Statements
S22;S24/25
4.1 RIDADR
OTH
4.1 WGK Germany
3
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: 426.472g/mol
  • Molecular Formula: C14H12N2O3
  • Compound Is Canonicalized: True
  • XLogP3-AA:
  • Exact Mass: 426.15795719
  • Monoisotopic Mass: 426.15795719
  • Complexity: 663
  • Rotatable Bond Count: 7
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Topological Polar Surface Area: 91.4
  • Heavy Atom Count: 32
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count: 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 1
6. Recommended Suppliers
Global149SuppliersView all >>
  • Products:Pharmaceutical raw materials,Chemical reagent, Food aditives,Plant ExtracPharmaceutical and pesticide intermediates.
  • Tel:86-431-81915458
  • Email:cathytan@jltely.com
(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1H-indol-3-yl)propanoate
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/gram
  • Time: 2022/06/30
Inquire
  • Products:Division I, the main production Lead acetate phenylacetamide Cyromazine quality is very good!
  • Tel:86-156-33831222
  • Email:xing@yan-xi.com
Fmoc-D-Trp-OH
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2022/06/30
Inquire
  • Products:Chemical products
  • Tel:86-571-88938639
  • Email:sales-gc@chinadayangchem.com
Fmoc-D-Tryptophan
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/kilogram
  • Time: 2022/06/30
Inquire
  • Products:Pharmaceutical, chemical technology research and development
  • Tel:086-0532-80960264
  • Email:derek@believechem.com
Fmoc-D-tryptophan
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 1 USD/gram
  • Time: 2022/06/30
Inquire
  • Products:We ZERchem, facing global High-tech pharmaceutical raw materials, high value-added new type intermediates fine chemicals custom synthesis, scale-up production and rare chemicals trade.
  • Tel:+86-571-82512721
  • Email:sales@zeerrui.com
Fmoc-D-tryptophan
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2022/06/30
Inquire