Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed U   > UXFFNZZREBTEOG-UHFFFAOYSA-N
791625-60-0 structure

UXFFNZZREBTEOG-UHFFFAOYSA-N

Iupac Name:(3S)-4-(4-chlorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
CAS No.:791625-60-0
Molecular Weight:325.789
Molecular Formula:C25H24N4O3S (isomer)
Names and Identifiers
Synonyms

4-quinazolinamine, 7-hydrazinyl- 7-hydrazino-quinazolin-4-ylamine AKOS006339436 SCHEMBL2777608

Inchi
InChI=1S/C16H20ClNO4/c1-16(2,3)22-15(21)18-8-12(13(9-18)14(19)20)10-4-6-11(17)7-5-10/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)/t12?,13-/m1/s1
InChkey
NSBYJYHHDUOADW-ZGTCLIOFSA-N
Canonical Smiles
CC(C)(C)OC(=O)N1CC(C(C1)C(=O)O)C2=CC=C(C=C2)Cl
Properties
Refractive Index
1.557
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

Computational chemical data
  • Molecular Weight:325.789g/mol
  • Molecular Formula:C25H24N4O3S
  • Compound Is Canonicalized:True
  • Exact Mass:325.108
  • Monoisotopic Mass:325.108
  • Complexity:426
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:66.8A^2
  • Heavy Atom Count:22
  • Defined Atom Stereocenter Count:1
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB6OAAEAAAAAAAAAAAAAAAAAWAAAAAwAAAAAAAAAAABAAAAHgIACAAADUbBmCQyCIMABgCI AiDSGAACAAAgBQAIiAEIAogIIDqBkxGMYAAmhgCIiAe8yOCOhAAAAAAAAAAIAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-571-89925085
  • Fax:86-571-89925065
  • Tel:1-631-5046093
  • Fax:1-631-6147828
  • Tel:1-631-5046093
  • Fax:1-631-6147828
  • Tel:+86-(21)-31263688
  • Fax:+86-(21)-51862199
Recommended Suppliers
  • Tel:86-571-89925085
  • Fax:86-571-89925065
  • Tel:1-631-5046093
  • Fax:1-631-6147828
  • Tel:1-631-5046093
  • Fax:1-631-6147828
  • Tel:+86-(21)-31263688
  • Fax:+86-(21)-51862199
 
<