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Substance Name: 3-Dehydroretinal
RN: 472-87-7
UNII: HV8T003XO1
InChIKey: QHNVWXUULMZJKD-OVSJKPMPSA-N

Molecular Formula

  • C20-H26-O

Molecular Weight

  • 282.4244
 
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Names and Synonyms

Name of Substance

  • 3-Dehydroretinal
  • Dehydroretinal

Synonyms

  • EINECS 207-457-7
  • UNII-HV8T003XO1

Systematic Names

  • 3,4-Didehydroretinal
  • Dehydroretinaldehyde

Registry Numbers

CAS Registry Number

  • 472-87-7

FDA UNII

  • HV8T003XO1

System Generated Number

  • 0000472877

Structure Descriptors

InChI

1S/C20H26O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6-13,15H,14H2,1-5H3/b9-6+,12-11+,16-8+,17-13+

InChIKey

QHNVWXUULMZJKD-OVSJKPMPSA-N

Smiles

C\C(=C/C=O)\C=C\C=C(/C)\C=C\C1=C(C)C=CCC1(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 77.5 deg C   EXP
log P (octanol-water) 7.390 (none)   EST
Atmospheric OH Rate Constant 4.17E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.