Skip to main content

butanoic acid, 2-methyl-, methyl ester

fruity ester Key food odorant

Found in 1 ingredient across the CompKitchen flavor graph.

Look up another compound — search by name, CAS number, PubChem CID, or FEMA #.

Key food odorant (intermediary)

Dunkel et al. 2014

Identified in the meta-analysis of 227 food samples as one of 57 intermediary odorants — appears in 5–25% of foods. Characteristic odor: fruity, apple.

Source: Angew. Chem. Int. Ed. 2014, 53, 7124–7143

Properties

Odor threshold — orthonasal, in clean water
0.004 ppb – 0.250 ppb median 0.127 ppb · 2 published values · see all 3 with sources
CAS number
868-57-5
Retention index
985
Not in FEMA GRAS publications 1-33. Of 3,367 listed flavoring substances, none match this compound name. May still be food-safe under other regulatory routes (FDA 21 CFR 172, EFSA, JECFA) — check femaflavor.org for the authoritative current list.

Published thresholds

3 measured values from the literature. Grouped by what was actually measured — a threshold smelled in clean water, tasted in the mouth, or measured in a real food are three different quantities and are not pooled.

Orthonasal, in clean water

0.004 ppb – 0.250 ppb

The reference measurement — smelled in water. OAV is computed against this.

Threshold Matrix Source Paper
0.004 ppb SIDA water Rychlik 1998 · 1 studies —
0.250 ppb water_odor Leffingwell —

In air

0.00015 ppb

Airborne detection — not comparable to a water threshold.

Threshold Matrix Source Paper
0.00015 ppb air (food: dill herb) Literature corpus —

Only values we can attribute are listed. Where a compendium's licence does not permit public attribution its figures are omitted here, so every number on this page traces to a citable source.

Thresholds in published tables

Numbers printed in open-access papers, grouped by the medium the table states. Median and full range of the values; “agree” means two or more papers whose middle 80% of values sit within 100×. Not reviewed.

MediumMedianRangeValuesPapersPapers agree?
air 0.5 µg/L air 0.1–3.9 32 yes
food matrix 0.3 ppb 0.25–1 33 yes
unstated 0.4 ppb 0.2–5 65 yes
water 0.25 ppb 0.25–0.25 22 yes

Found in

Measured impact first, then profile share

Every ingredient known to contain butanoic acid, 2-methyl-, methyl ester. Ingredients with a measured concentration come first, ranked by odour activity; the rest follow by how large a share of that ingredient's profile this molecule is. The figure beside each is how many different compounds that ingredient has in total — not the concentration of butanoic acid, 2-methyl-, methyl ester in it.

Into the chemistry?

Get a molecule-level pairing breakdown each week — which ingredients share a compound, and why it matters at the table. Free, no spam.

Prefer an account? Create a free account to save pairings and unlock the full chemistry.

Try the pairing tools to see which ingredient combinations rely on butanoic acid, 2-methyl-, methyl ester, or compare two ingredients side-by-side.