CompoundList
Sign in
Nitriles, nitro and azo compounds

4-Nitro-3-hexanol

Also known as 4-nitrohexan-3-ol, 4-hydroxy-3-nitrohexane

CAS 5342-71-2Formula C6H13NO3Molar mass 147.17 g/molEC 661-444-4
GHS signal word: Warning. Pictograms: Harmful or irritant
Get quotes Safety data
4-Nitro-3-hexanol chemical structure, C6H13NO3, CAS 5342-71-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
5342-71-2
Formula
C6H13NO3
Molar mass
147.17 g/mol
EC number
661-444-4
HS code
290559
Category
Nitriles, nitro and azo compounds

What is 4-Nitro-3-hexanol?

Plain description, key identifiers and synonyms

4-Nitro-3-hexanol is a chemical substance with the molecular formula C6H13NO3 and a molar mass of 147.17 g/mol. Its CAS registry number is 5342-71-2. The IUPAC name is 4-nitrohexan-3-ol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-nitrohexan-3-ol
CAS number
5342-71-2 CAS number cross-checked
EC number
661-444-4
Molecular formula
C6H13NO3
InChIKey
XIXNQTGGBNDDMJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H13NO3/c1-3-5(7(9)10)6(8)4-2/h5-6,8H,3-4H2,1-2H3
SMILES (canonical and isomeric)
CCC(C(CC)O)[N+](=O)[O-]

Synonyms

  • 4-nitrohexan-3-ol
  • 4-hydroxy-3-nitrohexane

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
147.17 g/molcalc.
Exact mass
147.0895 Dacalc.
LogP (octanol/water)
0.81calc.
Topological polar surface area
63.37 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
4calc.
Heavy atoms
10calc.
Rings
0calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
Formal charge
0calc.
Stereocentres
2calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302Harmful if swallowed.
Precautionary statements (5)
  • P264Wash skin thoroughly after handling.
  • P270Do not eat, drink or smoke when using this product.
  • P301 + P317If swallowed: Get medical help.
  • P330Rinse mouth.
  • P501Dispose of contents and container in accordance with local regulations.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Full safety data and first aid

4-Nitro-3-hexanol suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade 4-Nitro-3-hexanol can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

4-Nitro-3-hexanol price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code 4-Nitro-3-hexanol is traded under.

HS 2905.59Indicative HS code

Halogenated, sulphonated, nitrated or nitrosated derivatives of acyclic alcohols, other

World exports in 2024
$210M
+1.6% vs 2023, imports $201M
2019 to 2024
Top exporters
  1. China43.9%
  2. Germany11.6%
  3. Spain6.9%
Top importers
  1. Germany17.1%
  2. United States13.4%
  3. India * partner reported12.4%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for 4-Nitro-3-hexanol is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 4-Nitro-3-hexanol, based on the data on this page

What is 4-Nitro-3-hexanol?

4-Nitro-3-hexanol is a chemical substance with the molecular formula C6H13NO3 and a molar mass of 147.17 g/mol. Its CAS registry number is 5342-71-2. The IUPAC name is 4-nitrohexan-3-ol.

What is the CAS number of 4-Nitro-3-hexanol?

The CAS registry number of 4-Nitro-3-hexanol is 5342-71-2.

What is the molecular formula and weight of 4-Nitro-3-hexanol?

The molecular formula of 4-Nitro-3-hexanol is C6H13NO3 and its molar mass is 147.17 g/mol.

What is 4-Nitro-3-hexanol used for?

Known uses and roles of 4-Nitro-3-hexanol include building blocks in research and laboratory.

Is 4-Nitro-3-hexanol hazardous?

4-Nitro-3-hexanol carries the GHS signal word "Warning". Main hazards: harmful if swallowed. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of 4-Nitro-3-hexanol?

4-Nitro-3-hexanol is usually classified under HS code 290559 (Halogenated, sulphonated, nitrated or nitrosated derivatives of acyclic alcohols, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 4-Nitro-3-hexanol?

Post a free request on CompoundList and suppliers of 4-Nitro-3-hexanol will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 4-Nitro-3-hexanol?

Suppliers quote 4-Nitro-3-hexanol on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle 4-Nitro-3-hexanol

Get quotes for 4-Nitro-3-hexanol

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell 4-Nitro-3-hexanol
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of 4-Nitro-3-hexanol with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/4-nitro-3-hexanol-5342-71-2" title="4-Nitro-3-hexanol structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Nitriles, nitro and azo compounds or HS code 290559

Price on request
Free quotes, contact stays private
Get quotes