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Safranal

Safranal structure

Safranal 

structure
  • CAS No:

    116-26-7

  • Formula:

    C10H14O

  • Chemical Name:

    Safranal

  • Synonyms:

    1,3-Cyclohexadiene-1-carboxaldehyde,2,6,6-trimethyl-;2,6,6-Trimethyl-1,3-cyclohexadiene-1-carboxaldehyde;Safranal;2,2,6-Trimethyl-4,6-cyclohexadien-1-aldehyde;2,6,6-Trimethyl-1,3-cyclohexadiene-1-aldehyde;2,6,6-Trimethylcyclohexa-1,3-dienecarboxaldehyde;2,6,6-Trimethylcyclohexa-1,3-diene-1-carbaldehyde;2,6,6-Trimethylcyclohexa-1,3-dienecarbaldehyde;2,3-Dihydro-2,2,6-trimethylbenzaldehyde

  • Categories:

    Cosmetic Ingredient  >  Perfuming

Description

2,6,6-Trimethylcyclohexa-1,3-dienyl methanal has a characteristic saffron-like odor and taste.ChEBI: A monoterpenoid formally derived from beta-cyclocitral by dehydrogenation.


Solid|Pale yellowish oily liquid; powerful, sweet green-floral and somewh/ tobacco-herbaceous odour.


Safranal is a monoterpenoid formally derived from beta-cyclocitral by dehydrogenation. It derives from a beta-cyclocitral.

Safranal Basic Attributes

150.22

150.22

204-133-7

4393FR07EA

DTXSID7049398

2912299000

Characteristics

17.1

2.48790

Solid

0.966 g/mL at 25 °C(lit.)

<25 °C

70 °C

186 °F

n 20/D 1.523(lit.)

Insoluble in water; soluble in oils

0.134mmHg at 25°C

Safety Information

3

36/37/38

26-36

Xi

P261-P305 + P351 + P338

H315-H319-H335

|Warning|H302 (78.78%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 1682 companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

2,6,6-trimethyl-1,3-cyclohexadiene-1-carboxaldehyde

Safranal Use and Manufacturing

1,3-Cyclohexadiene-1-carboxaldehyde, 2,6,6-trimethyl-: ACTIVE

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Flavoring Agents

Computed Properties

Molecular Weight:150.22
XLogP3:2.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:150.104465066
Monoisotopic Mass:150.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:231
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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