Skip to main content

3-mercapto-3-methylbutyl formate

sulfurous ester Key food odorant

Found in 2 ingredients across the CompKitchen flavor graph.

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

2D Lewis structure of 3-mercapto-3-methylbutyl formate
2D Lewis Structure
Formula
C6H12O2S
Molecular weight
148.23 g/mol
PubChem CID
526487 — full record on PubChem

Key food odorant (individualist)

Dunkel et al. 2014

Identified in the meta-analysis of 227 food samples as one of 151 individualist odorants — appears in <5% of foods, carries the diagnostic signature of specific ingredients.

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

Properties

Odor description
cat, roast
Odor threshold — orthonasal, in clean water
0.003 ppb 1 published value · see all 1 with sources
Volatility
high
CAS number
50746-10-6
Regulatory · United States

FEMA GRAS — Generally Recognized As Safe for flavoring use

✓ Exact match
FEMA number
3855
GRAS publication
GRAS 18
FEMA primary name
3-MERCAPTO-3-METHYLBUTYL FORMATE

Use-level matrix not extracted for this substance — check the source publication for current ppm guidance.

Source: FEMA GRAS publications 1-33.

How this molecule is described

Sources disagree about odour more often than they disagree about chemistry. Rather than show one answer, here is every description on file with how many ingredient records carry it.

Descriptions on file

Ordered by how many independent descriptor streams give each wording, then by how often it appears. The bar is still replication — one source copied onto many ingredients scores high there — so the two can disagree.

cat, roast shown above Flavornet Cas
—
cat, fruity, herbal, roast, roasted, sweaty FlavorDB 2.0
1
cat, roast, fruity, herbal, roasted, sweaty FlavorDB 2.0
1

Bars are the share of ingredient records carrying each description. High agreement means the sources replicate each other — not necessarily that they are right.

Published thresholds

1 measured value 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

0.003 ppb

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

Threshold Matrix Source Paper
0.003 ppb SIDA water Rychlik 1998 · 2 studies —

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.

Found in

Measured impact first, then profile share

Every ingredient known to contain 3-mercapto-3-methylbutyl formate. 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 3-mercapto-3-methylbutyl formate 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 3-mercapto-3-methylbutyl formate, or compare two ingredients side-by-side.