(2Z,4Z,6Z,8E,10Z,12E,14E,16E,18E)-20-Methoxy-4,8,12,16-tetramethyl-20-oxo-2,4,6,8,10,12,14,16,18-icosanonaenoic acid | CAS No. 6983-79-5

(2Z,4Z,6Z,8E,10Z,12E,14E,16E,18E)-20-Methoxy-4,8,12,16-tetramethyl-20-oxo-2,4,6,8,10,12,14,16,18-icosanonaenoic acid

Basic Information

CAS Number

6983-79-5

Molecular Formula

C25H30O4

Molecular Weight

394.51 g/mol

AD

Basic Physical Properties

Melting Point

214.5-215.5 ºC (acetone )

Boiling Point

438.7°C (rough estimate)

Density

1.035±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

197.8 °C

Solubility

Insuluble (9.9E-3 g/L) (25 ºC),

Refractive Index

1.4460 (estimate)

Vapor Pressure

Not available

CC(=CC=CC=C(C)C=CC=C(C)C=CC(=O)OC)C=CC=C(C)C=CC(=O)O

InChI

InChI=1S/C25H30O4/c1-20(12-7-13-22(3)16-9-17-25(28)29-5)10-6-11-21(2)14-8-15-23(4)18-19-24(26)27/h6-19H,1-5H3,(H,26,27)/b10-6-,13-7+,14-8-,17-9+,19-18-,20-12+,21-11+,22-16+,23-15-

InChIKey

PETQSXXQDKKRJS-OWLMNNLMSA-N

LogP

5.810200000000006

Topological Polar Surface Area

63.60000000000001 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

823

Safety Information

View Safety Information

Storage Conditions

-20℃

Synonyms & References

English

  • EINECS 230-248-7
  • CAS-6983-79-5
  • 6983-79-5
  • C08582
  • BIXIN (MART.)
  • UNII-9L7T4VB66G
  • .ALPHA.-BIXIN
  • CHEMBL1172615
  • Isobixin
  • CCRIS 9384
  • (2E,4E,6E,8E,10E,12E,14E,16Z,18E)-20-methoxy-4,8,13,17-tetramethyl-20-oxoicosa-2,4,6,8,10,12,14,16,18-nonaenoic acid
  • DTXSID1024629
  • MS-26633
  • CHEBI:3136
  • Stable bixin
  • 6'-methyl hydrogen 9'-cis-6,6'-diapocarotene-6,6'-dioate
  • BIXINS CIS-FORM
  • 9L7T4VB66G
  • 6,6'-DIAPO-psi,psi-CAROTENEDIOIC ACID, 6-METHYL ESTER, 9-CIS-
  • Bixin
  • 20-methoxy-4,8,13,17-tetramethyl-20-oxoicosa-2,4,6,8,10,12,14,16,18-nonaenoic acid
  • Methyl (9-cis)-hydrogen-6,6'-diapo-psi,psi-carotenedioate
  • 2,4,6,8,10,12,14,16,18-EICOSANONAENEDIOIC ACID, 4,8,13,17-TETRAMETHYL-, 1-METHYL ESTER, (2E,4Z,6E,8E,10E,12E,14E,16E,18E)-
  • a-Bixin
  • HY-N6884
  • DTXCID304535
  • Bixin, >=95.0% (HPLC)
  • alpha-Bixin
  • Tox21_303095
  • E160b
  • SCHEMBL9939959

MDL Number

MFCD00016545

Customs Code

38200000

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