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Home> Hot Product Listed F   > F1458-0032
5441-28-1 structure

F1458-0032

Iupac Name:1,4-bis(4-methoxyphenyl)phthalazine
CAS No.:5441-28-1
Molecular Weight:342.398
Molecular Formula:C17H20N4O3 (isomer)
Names and Identifiers
Synonyms

(e)-n-(3-(4-bromophenyl)-5,5-dioxidotetrahydrothieno[3,4-d]thiazol-2(3h)-ylidene)-3-nitrobenzamide 4-(4-bromophenyl)-5-[2-(3-nitrophenyl)-2-oxo-1-azaethylidene]-1,3,4,6,3a,6a-he xahydro-2,6-dithia-4-azapentalene-2,2-dione AC1MOU6R AKOS001694200 AKOS016087939 AS-871/42216514 MCULE-8716988893 MOLPORT-000-247-013 MOLPORT-027-853-824 n-(3-(4-bromophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3h)-ylidene)-3-nitrobenzamide n-[(2e)-3-(4-bromophenyl)-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3h)-ylidene]-3-nitrobenzamide n-[(2e)-3-(4-bromophenyl)-5,5-dioxo-tetrahydro-5??-thieno[3,4-d][1,3]thiazol-2-ylidene]-3-nitrobenzamide n-[3-(4-bromophenyl)-5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-3-nitrobenzamide ST50100624 VU0494351-1 wizcnuyfxiyums-uhfffaoysa-n

Inchi
InChI=1S/C22H18N2O2/c1-25-17-11-7-15(8-12-17)21-19-5-3-4-6-20(19)22(24-23-21)16-9-13-18(26-2)14-10-16/h3-14H,1-2H3
InChkey
SXWJXIUDVYZJFA-UHFFFAOYSA-N
Canonical Smiles
COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)OC
Properties
Refractive Index
1.631
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:342.398g/mol
  • Molecular Formula:C17H20N4O3
  • Compound Is Canonicalized:True
  • Exact Mass:342.137
  • Monoisotopic Mass:342.137
  • Complexity:390
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Heavy Atom Count:26
  • 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
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