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Home> Hot Product Listed O   > OPREA1_178383
1760-46-9 structure

OPREA1_178383

Iupac Name:(2,2-diphenylacetyl) 2,2-diphenylacetate
CAS No.:1760-46-9
Molecular Weight:406.481
Molecular Formula:C32H48O4 (isomer)
Names and Identifiers
Synonyms

AC1MJWJ7 AKOS000123935 BG01797438 CTK7E8960 n-(2-aminoethyl)-n-(4-methoxy-2-nitrophenyl)amine n-(4-methoxy-2-nitrophenyl)-1,2-ethanediamine n'-(4-methoxy-2-nitrophenyl)ethane-1,2-diamine n-(4-methoxy-2-nitrophenyl)ethane-1,2-diamine n1-(4-methoxy-2-nitrophenyl)ethane-1,2-diamine SCHEMBL2472513 STK052138 ZINC4851824

Inchi
InChI=1S/C28H22O3/c29-27(25(21-13-5-1-6-14-21)22-15-7-2-8-16-22)31-28(30)26(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20,25-26H
InChkey
YZMRCMTTYLBDPD-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4
Properties
Melting Point
96.0 to 100.0 °C
Vapour
1.97E-12mmHg at 25°C
Refractive Index
1.615
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 1760-46-9 EC: OPREA1_178383 ·ECHA C&L Inventory for CAS: CAS: 1760-46-9 EC: OPREA1_178383
Computational chemical data
  • Molecular Weight:406.481g/mol
  • Molecular Formula:C32H48O4
  • Compound Is Canonicalized:True
  • Exact Mass:406.157
  • Monoisotopic Mass:406.157
  • Complexity:475
  • Rotatable Bond Count:8
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:43.4A^2
  • Heavy Atom Count:31
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB4MAAAAAAAAAAAAAAAAAAAAAAAAAAwYMGAAAAAAAABVAAAGgAAAAAADQCAmAAwCIAABACI AiDSCAACAAAgAAAIiAEAAIgIIDKAFRCCIAAkwAEIiAeIyOCOgAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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