Caffeine

CAS:
58-08-2
Family:
xanthine alkaloid
Also:
1,3,7-Trimethylxanthine, Caffeine, Guaranine, Theine

Found heavily in (1 oils total)

Recorded sensory reference values
  • Affect valence: -0.05
  • Affect arousal: 0.35

Reference values depend on measurement conditions and do not describe an effective dose or the perception of a custom blend.

Caffeine is a naturally occurring xanthine alkaloid best known from coffee, tea, cacao, and guarana, and in the AromaForge archive it also appears as a minor marker in coffee bean oil. The strongest public evidence is not about fragrance use but about oral exposure: chemistry databases clearly identify the compound, human research consistently links it with alertness and sleep disruption, and regulator-facing safety summaries set practical intake guardrails for most adults. For archive-safe copy, caffeine is best framed as a well-characterized stimulant alkaloid with strong mechanism and human-effect literature, while keeping claims away from medical treatment language.

Chemical identity and composition

PubChem lists caffeine as C8H10N4O2 with IUPAC name 1,3,7-trimethylpurine-2,6-dione. It is a methylxanthine alkaloid that occurs naturally in coffee and tea and is also added to many consumer products. In the archive's coffee bean oil record, caffeine is treated as a minor quantified constituent based on a recent coffee-oil review.

Aroma and practical use

bitterfaintly roastedalkaloid
  • Use the recorded bitter, faintly roasted, alkaloid descriptors to explore a blend's scent character; perceived strength also depends on the other ingredients.
  • Compare the recorded goal signals with the intended purpose, while keeping model assumptions separate from observed study outcomes.
  • Read the route, preparation and experimental context before using a study finding to choose an oil.

Reported benefits and effects

Findings retain their study context. An animal or laboratory result describes that experiment.

sleep deprivation performance

Repeated 200 mg and 300 mg caffeine doses mitigated neurobehavioral impairment during total sleep deprivation, with the clearest benefit during the nighttime circadian low, but neither dose restored performance to well-rested levels.

human researchRoute not recordedrandomized, double-blind, placebo-controlled crossover study in 12 healthy adults during 48 hours of total sleep deprivation

Measured: psychomotor vigilance and subjective sleepiness

Apply this finding only to the studied preparation, participants, route and outcome. It does not establish the same result for a custom oil blend.

sleep disruption timing

A 400 mg caffeine dose significantly disrupted sleep even when taken 6 hours before habitual bedtime, supporting conservative timing guidance around evening use.

human researchRoute not recordedhome sleep study comparing 400 mg caffeine at bedtime, 3 hours before bed, or 6 hours before bed versus placebo

Measured: self-reported and objective sleep disturbance

Apply this finding only to the studied preparation, participants, route and outcome. It does not establish the same result for a custom oil blend.

coffee oil occurrence

A 2024 review summarized roasted coffee oil composition data and reported caffeine around 0.35% in one cited profile, supporting its role as a minor coffee-oil marker rather than a dominant aromatic constituent.

reference dataRoute not recordedreview of coffee-oil extraction methods and composition

Measured: reported roasted coffee oil composition

This reference does not establish a therapeutic result or a safe use level for a custom oil blend.

How it contributes to goal calculations

Model markers guide the formulation score. They are separate from the source findings above.

energy/invigorationSupporting signal · systemichuman research · Randomized, double-blind, placebo-controlled, crossover study of the effects of repeated-dose caffeine on neurobehavioral performance during 48 h of total sleep deprivation
focus/concentrationSupporting signal · systemichuman research · Randomized, double-blind, placebo-controlled, crossover study of the effects of repeated-dose caffeine on neurobehavioral performance during 48 h of total sleep deprivation
sleepConflicting signal · systemichuman research · Caffeine effects on sleep taken 0, 3, or 6 hours before going to bed

Use concerns and concentration limits

Sensitization concernNot flagged

Not flagged in the current model. This is not proof of absence or unrestricted safety.

Phototoxicity concernNot flagged

Not flagged in the current model. This is not proof of absence or unrestricted safety.

Oxidation concernNot flagged

Not flagged in the current model. This is not proof of absence or unrestricted safety.

Penetration enhancementNot flagged

Not flagged in the current model. This is not proof of absence or unrestricted safety.

No numeric constituent-specific use limit is available here. Missing is not an unrestricted-use clearance.

FDA consumer guidance updated August 28, 2024 states that for most adults about 400 mg per day is not generally associated with negative effects, while sensitivity varies by person, medications, and health context.
not specifiedRoute not recorded

This reference does not establish a therapeutic result or a safe use level for a custom oil blend.

No direct public citation is attached to this entry.

EFSA's scientific opinion concluded that single doses up to 200 mg and habitual intakes up to 400 mg per day do not raise safety concerns for non-pregnant adults in the general population, and up to 200 mg per day was considered acceptable during pregnancy.
not specifiedRoute not recorded

This reference does not establish a therapeutic result or a safe use level for a custom oil blend.

No direct public citation is attached to this entry.

Public-health sources and human studies consistently note insomnia, jitters, anxiety, palpitations, and other stimulant effects when intake is excessive or poorly timed.
not specifiedRoute not recorded

This reference does not establish a therapeutic result or a safe use level for a custom oil blend.

No direct public citation is attached to this entry.

Constituents it may interact with

No constituent-pair interaction is recorded for this identity. The report does not assume either amplification or incompatibility.

How the effects were investigated

adenosine receptor antagonism

Adenosine receptor antagonism is the main established mechanism behind caffeine's central stimulant effects, especially through A1 and A2A signaling.

mechanistic reviewRoute not recorded

This reference does not establish a therapeutic result or a safe use level for a custom oil blend.

No direct public citation is attached to this entry.

What this report cannot establish

  • A reported constituent percentage does not establish an effective human therapeutic dose or the amount absorbed into the body.
  • The presence of a constituent does not guarantee a clinical benefit, rash treatment or sleep improvement from a custom blend.
  • An unflagged concern or missing use limit does not establish safety for ingestion, inhalation, skin exposure or a particular person.
  • A candidate constituent interaction does not establish that two oils amplify one another at the selected proportions.
  • Constituent descriptors alone do not establish a precise top, heart or base lifetime in a finished blend.
Known data gaps (5)
  • The strong caffeine literature is dominated by oral exposure, not inhalation or fragrance-use studies, so archive descriptions should not imply aroma-route outcomes.
  • No constituent-specific dermal limit or IFRA-style restriction for isolated caffeine was located in the reviewed public sources for this pass.
  • A c6 verification search (2026-07-13) confirmed no RIFM/IFRA fragrance dermal-limit assessment exists for caffeine (it is not used as a fragrance ingredient); the prior unsourced 0.1% dermal_limit_pct was corrected to null.
  • No constituent-specific numeric dermal reference is available here.
  • Some findings do not record an explicit exposure route; consult the linked study before applying them to a use.
All public references (8)