CompoundList
Sign in
Screening compounds

LightOx17

CAS 2188204-80-8Formula C25H27NO2Molar mass 373.50 g/mol
Get quotes Safety data
LightOx17 chemical structure, C25H27NO2, CAS 2188204-80-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2188204-80-8
Formula
C25H27NO2
Molar mass
373.50 g/mol
HS code
293349
Category
Screening compounds

What is LightOx17?

Plain description, key identifiers and synonyms

LightOx17 is a chemical substance with the molecular formula C25H27NO2 and a molar mass of 373.50 g/mol. Its CAS registry number is 2188204-80-8. The IUPAC name is (E)-3-[4-[2-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-6-yl)ethynyl]phenyl]prop-2-enoic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(E)-3-[4-[2-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-6-yl)ethynyl]phenyl]prop-2-enoic acid
CAS number
2188204-80-8
Molecular formula
C25H27NO2
InChIKey
BSLSUZAOTWTTLD-WYMLVPIESA-N
InChI
InChI=1S/C25H27NO2/c1-18(2)26-16-15-25(3,4)22-17-21(11-13-23(22)26)10-9-19-5-7-20(8-6-19)12-14-24(27)28/h5-8,11-14,17-18H,15-16H2,1-4H3,(H,27,28)/b14-12+
Canonical SMILES
CC(C)N1CCC(C)(C)c2cc(C#Cc3ccc(C=CC(=O)O)cc3)ccc21
Isomeric SMILES
CC(C)N1CCC(C2=C1C=CC(=C2)C#CC3=CC=C(C=C3)/C=C/C(=O)O)(C)C

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
373.50 g/molcalc.
Exact mass
373.2042 Dacalc.
LogP (octanol/water)
5.08calc.
Topological polar surface area
40.54 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
3calc.
Heavy atoms
28calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.32calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (1 violation)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, C(#Cc1ccc2c(c1)CCCN2)c1ccccc1

C(#Cc1ccc2c(c1)CCCN2)c1ccccc1

3 rings, 18 atoms.

3 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

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

LightOx17 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 LightOx17 can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

LightOx17 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 LightOx17 is traded under.

HS 2933.49Indicative HS code

Compounds containing in the structure a quinoline or isoquinoline ring-system (whether…

World exports in 2024
$939M
−14.6% vs 2023, imports $1.48B
2019 to 2024
Top exporters
  1. China30.1%
  2. India * partner reported16.7%
  3. Switzerland * partner reported14.1%
Top importers
  1. United Kingdom19.2%
  2. Germany16.0%
  3. Romania8.3%

* Partner reported figures, a lower bound.

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

The HS code shown for LightOx17 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about LightOx17, based on the data on this page

What is LightOx17?

LightOx17 is a chemical substance with the molecular formula C25H27NO2 and a molar mass of 373.50 g/mol. Its CAS registry number is 2188204-80-8. The IUPAC name is (E)-3-[4-[2-(4,4-dimethyl-1-propan-2-yl-2,3-dihydroquinolin-6-yl)ethynyl]phenyl]prop-2-enoic acid.

What is the CAS number of LightOx17?

The CAS registry number of LightOx17 is 2188204-80-8.

What is the molecular formula and weight of LightOx17?

The molecular formula of LightOx17 is C25H27NO2 and its molar mass is 373.50 g/mol.

What is LightOx17 used for?

Known uses and roles of LightOx17 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is LightOx17 hazardous?

No GHS hazard classification for LightOx17 is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of LightOx17?

LightOx17 is usually classified under HS code 293349 (Compounds containing in the structure a quinoline or isoquinoline ring-system (whether…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy LightOx17?

Post a free request on CompoundList and suppliers of LightOx17 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of LightOx17?

Suppliers quote LightOx17 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 LightOx17

Get quotes for LightOx17

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell LightOx17
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 LightOx17 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/lightox17-2188204-80-8" title="LightOx17 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 Screening compounds or HS code 293349

Price on request
Free quotes, contact stays private
Get quotes