Learn · Organic Chemistry

Degrees of unsaturation

How to calculate degrees of unsaturation (the index of hydrogen deficiency) from a molecular formula, with rules for heteroatoms.

Quick answer Degrees of unsaturation (DoU) count the rings plus π bonds in a molecule, read straight off the formula: DoU = (2C + 2 + N − H − X) / 2. Each degree is one ring or one π bond — C=C/C=O = 1, triple bond = 2, benzene = 4; O and S are ignored.

DoU measures how far a molecule sits from the saturated alkane — each ring or π bond removes two hydrogens, so counting missing H tells you how many are present before you draw anything.

Hexane · C₆H₁₄ · 0 DoU
Cyclohexene · C₆H₁₀ · 2 DoU
Benzene · C₆H₆ · 4 DoU

Same six carbons, three different levels of unsaturation — read directly from each formula. Structures drawn live.

1. Each Ring or π Bond Is Exactly One Degree of Unsaturation

From the alkane CnH2n+2, closing a ring or adding one double bond each removes an H₂, so both cyclohexane and 1-hexene (C₆H₁₂) are 1 DoU — the formula can't tell them apart.

Cyclohexane · C₆H₁₂ · 1 DoU (one ring)
1-Hexene · C₆H₁₂ · 1 DoU (one π bond)

2. DoU = (2C + 2 + N − H − X) / 2

The formula gives the saturated max hydrogen count (2C + 2), subtracts the H you have, and halves the difference; benzene C₆H₆ works out to (12 + 2 − 6)/2 = 4.

Benzene · (12 + 2 − 6)/2 = 4 DoU

3. Oxygen and Sulfur Are Free; Nitrogen Adds One; Halogens Count Like Hydrogen

Valence explains it: divalent O and S add no H (dropped), trivalent N adds one to the numerator, monovalent halogens count like H — so acetone is 1, acetic acid 1, and acetonitrile 2.

Acetone · C₃H₆O · 1 DoU (C=O)
Acetic acid · C₂H₄O₂ · 1 DoU
Acetonitrile · C₂H₃N · 2 DoU

4. Triple Bonds Count as Two, and a Benzene Ring Counts as Four

A triple bond stacks two π bonds (hex-1-yne = 2) and a benzene ring bundles four (three π bonds + one ring), so fused naphthalene reaches 7 — recognizing these bundles consumes big chunks of a total at once.

Hex-1-yne · C₆H₁₀ · 2 DoU (triple bond)
Naphthalene · C₁₀H₈ · 7 DoU

5. Work Backward: DoU Turns a Formula Into a Short List of Structures

DoU narrows the candidates: C₆H₈ = 3 points to 1,3-cyclohexadiene (ring + two double bonds), while aniline's 4 again forces an aromatic ring, now bearing nitrogen.

1,3-Cyclohexadiene · C₆H₈ · 3 DoU
Aniline · C₆H₇N · 4 DoU

6. DoU Is Your First Move in Spectroscopy Problems

Compute DoU from the formula (often the mass spec molecular ion) before reading spectra: 4+ says hunt for an aromatic ring in NMR and IR, as with styrene's 5 (ring 4 + vinyl 1).

Styrene · C₈H₈ · 5 DoU (ring 4 + vinyl 1)

7. Summary

DoU = (2C + 2 + N − H − X) / 2 · O and S ignored, N adds one, halogens count like H · each degree = one ring or π bond · triple bond = 2, benzene = 4 · 0 = saturated chain, 4+ = aromatic.

Worked example

Problem. How many degrees of unsaturation does C6H10 have, and what can that mean structurally?
  1. DoU = (2C + 2 + N − H − X) / 2.
  2. Here = (2·6 + 2 − 10) / 2 = (14 − 10) / 2 = 2.
  3. Two degrees = any mix of rings and/or π bonds: a ring + a double bond, two double bonds, or one triple bond.

Answer. 2 degrees of unsaturation (e.g. cyclohexene, a diene, or an alkyne).

Quiz yourself

Tap a question to reveal the answer — free, no login.

DoU = (2·4 + 2 − 6)/2 = 4/2 = 2. Two degrees could be two double bonds (1,3-butadiene), one ring plus one double bond (cyclobutene), two rings (bicyclobutane), or a single triple bond (but-1-yne or but-2-yne).

O and S are divalent — inserting an –O– or –S– into a saturated skeleton neither adds nor removes hydrogens, so they have no effect on the count. Nitrogen is trivalent, giving an extra bonding site, so each N adds one to the numerator (the "+ N" term).

Halogens count like hydrogen (the "− X" term): DoU = (2·6 + 2 − 11 − 1)/2 = 2/2 = 1. One ring or one double bond — for example chlorocyclohexane, or a chlorinated hexene.

DoU = (18 + 2 − 10)/2 = 5. Four of those degrees almost certainly belong to a benzene ring (the aromatic bundle), leaving one more — likely a C=O or a C=C. The oxygen plus a leftover degree points toward an aromatic aldehyde, ketone, or a phenyl vinyl ether. Confirm the carbonyl with an IR band near 1700 cm⁻¹.

Draw this on the whiteboard

Open the OChem Board whiteboard — benzene rings, wedge/dash bonds, and a clickable periodic table built in. No account needed.

Open the whiteboard →