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STOCK6S-98388 structure
STOCK6S-98388 structure

STOCK6S-98388

Iupac Name:tetrabromouranium
CAS No.: 13470-20-7
Molecular Weight:557.645
Modify Date.: 2022-05-23 00:44
1. Names and Identifiers
1.1 Name
STOCK6S-98388
1.2 Synonyms

3-(2,5-dimethoxyphenyl)-7-(4-isopropoxyphenyl)-4h,6h,7h-imidazo[4,5-b]pyridin-5-one 3-(2,5-dimethoxyphenyl)-7-[4-(propan-2-yloxy)phenyl]-6,7-dihydro-3h-imidazo[4,5-b]pyridin-5-ol AKOS005662969 AKOS032409309 BG00759765 MCULE-6148929335 MOLPORT-008-336-188 MOLPORT-008-355-281 STK933374

1.3 CAS No.
13470-20-7
1.4 CID
83507
1.5 Molecular Formula
C8H6N2O2 (isomer)
1.6 Inchi
InChI=1S/4BrH.U/h4*1H;/q;;;;+4/p-4
1.7 InChkey
IMNIORQANNGBDO-UHFFFAOYSA-J
1.8 Canonical Smiles
Br[U](Br)(Br)Br
1.9 Isomers Smiles
Br[U](Br)(Br)Br
2. Properties
3.1 Melting point
519°C
3.1 Precise Quality
553.72400
3.1 logP
-11.98400
3. Computational chemical data
  • Molecular Weight: 557.645g/mol
  • Molecular Formula: C8H6N2O2
  • Compound Is Canonicalized: True
  • XLogP3-AA:
  • Exact Mass: 557.72004
  • Monoisotopic Mass: 553.72414
  • Complexity: 19.1
  • Rotatable Bond Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Topological Polar Surface Area: 0
  • Heavy Atom Count: 5
  • 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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