(2S)-5-Hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one | CAS No. 2957-21-3

(2S)-5-Hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one

Basic Information

CAS Number

2957-21-3

Molecular Formula

C16H14O5

Molecular Weight

286.28 g/mol

AD

Basic Physical Properties

Physical State

Powder

Melting Point

153-154°C

Boiling Point

555.9°Cat760mmHg

Density

1.37

Flash Point

212.4°C

Solubility

109.2 mg/L @ 25 °C (est)

Refractive Index

1.668

Vapor Pressure

0.0±1.6 mmHg at 25°C

Specific Rotation

D16 +8.0° (c = 7.92 in acetone); D12 +8.4° (c = 6.28 in methanol)

COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC=C(C=C3)O)O

InChI

InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3/t14-/m0/s1

InChIKey

DJOJDHGQRNZXQQ-AWEZNQCLSA-N

LogP

2.8129000000000017

Topological Polar Surface Area

75.99000000000001 Ų

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

377

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Storage Conditions

2-8℃

Synonyms & References

English

  • (2S)-sakuranetin
  • CS-0022916
  • Flavanone, 4',5-dihydroxy-7-methoxy-, (S)-(-)-
  • SAKURANETIN [MI]
  • BDBM50312648
  • (2S)-5,4'-dihydroxy-7-methoxyflavan-4-one
  • (S)-(-)-4',5-dihydroxy-7-methoxyflavanone
  • (2S)-4',5-dihydroxy-7-methoxyflavanone
  • SCHEMBL555542
  • C09833
  • 7-O-Methylnaringenin
  • Q3459689
  • 4H-1-Benzopyran-4-one, 2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-, (2S)-
  • (S)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-4H-1-benzopyran-4-one
  • EINECS 220-980-5
  • 5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-chroman-4-one
  • 5,4'-Dihydroxy-7-methoxyflavanone
  • HY-N3006
  • DB08517
  • 5,4''-dihydroxy-7-methoxyflavanone
  • Naringenin 7-methyl ether
  • GTPL412
  • (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one
  • Sakuranetin, analytical standard
  • CHEMBL448297
  • (2S)--5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one
  • 3O38P61299
  • LMPK12140571
  • CHEBI:28927
  • AKOS027321114
  • (S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxychroman-4-one

MDL Number

MFCD00075651

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