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Home> Encyclopedia > Hot Product Listed 5   > 5H-Furo[3,2-g][1]benzopyran-5-one,7-(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-2,3,6,7-tetrahydro...
573-17-1 structure

5H-Furo[3,2-g][1]benzopyran-5-one,7-(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-2,3,6,7-tetrahydro-4-hydroxy-2-(4-hydroxyphenyl)-9-(3-methyl-2-buten-1-yl)-,(2S,3S,7S)-

Iupac Name:9-bromophenanthrene
CAS No.:573-17-1
EINECS(EC#): 221-849-5
Molecular Weight:257.12526
Molecular Formula:C22H16N2O4S (isomer)
Names and Identifiers
Synonyms

5H-Furo[3,2-g][1]benzopyran-5-one,7-(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-2,3,6,7-tetrahydro-4-hydroxy-2-(4-hydroxyphenyl)-9-(3-methyl-2-butenyl)-,(2S,3S,7S)- (9CI) 5H-Furo[3,2-g][1]benzopyran-5-one,7-(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-2,3,6,7-tetrahydro-4-hydroxy-2-(4-hydroxyphenyl)-9-(3-methyl-2-butenyl)-,[2S-(2a,3b,7b)]- Alopecurone F

Inchi
InChI=1S/C14H9Br/c15-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H
InChkey
RSQXKVWKJVUZDG-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)Br
Properties
Melting Point
60-65℃
Refractive Index
1.6799 (100.7 C)
HS Code
29036990
Safety and Handling
Risk Statements
R20/21/22
Safety Statements
S24/25
Transport
25kgs
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:257.12526g/mol
  • Molecular Formula:C22H16N2O4S
  • XLogP3-AA:5.1
  • Exact Mass:255.988763
  • Monoisotopic Mass:255.988763
  • Complexity:225
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:15
  • 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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