CompoundList
Sign in
Screening compounds

Bms641

Also known as 3-chloro-4-[(E)-2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethenyl]benzoic acid, BMS 641, 3-chloro-4-((E)-2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethenyl)benzoic acid

CAS 369364-50-1Formula C27H23ClO2Molar mass 414.93 g/mol
Get quotes Safety data
Bms641 chemical structure, C27H23ClO2, CAS 369364-50-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
369364-50-1
Formula
C27H23ClO2
Molar mass
414.93 g/mol
HS code
291639
Category
Screening compounds

What is Bms641?

Plain description, key identifiers and synonyms

BMS641 (BMS-209641) is a selective RARbeta agonist.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-chloro-4-[(E)-2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethenyl]benzoic acid
CAS number
369364-50-1
Molecular formula
C27H23ClO2
InChIKey
FRTYVAKGTFXRNY-CSKARUKUSA-N
InChI
InChI=1S/C27H23ClO2/c1-27(2)15-14-22(19-6-4-3-5-7-19)23-16-18(9-13-24(23)27)8-10-20-11-12-21(26(29)30)17-25(20)28/h3-14,16-17H,15H2,1-2H3,(H,29,30)/b10-8+
Canonical SMILES
CC1(C)CC=C(c2ccccc2)c2cc(C=Cc3ccc(C(=O)O)cc3Cl)ccc21
Isomeric SMILES
CC1(CC=C(C2=C1C=CC(=C2)/C=C/C3=C(C=C(C=C3)C(=O)O)Cl)C4=CC=CC=C4)C

Synonyms

  • 3-chloro-4-[(E)-2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethenyl]benzoic acid
  • BMS 641
  • 3-chloro-4-((E)-2-(5,5-dimethyl-8-phenyl-6H-naphthalen-2-yl)ethenyl)benzoic acid
  • (E)-3-Chloro-4-(2-(5,5-dimethyl-8-phenyl-5,6-dihydronaphthalen-2-yl)vinyl)benzoic acid

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
414.93 g/molcalc.
Exact mass
414.1387 Dacalc.
LogP (octanol/water)
7.32calc.
Topological polar surface area
37.3 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
1calc.
Rotatable bonds
4calc.
Heavy atoms
30calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.15calc.
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)C(c1ccccc1)=CCC2)c1ccccc1

C(=Cc1ccc2c(c1)C(c1ccccc1)=CCC2)c1ccccc1

4 rings, 24 atoms.

1 other chemical 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.

Bms641 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 Bms641 can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Bms641 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 Bms641 is traded under.

HS 2916.39Indicative HS code

Aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and…

World exports in 2024
$706M
−6.8% vs 2023, imports $714M
2019 to 2024
Top exporters
  1. China49.0%
  2. India * partner reported16.2%
  3. Germany13.2%
Top importers
  1. India * partner reported14.5%
  2. United States12.2%
  3. Germany8.6%

* Partner reported figures, a lower bound.

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

The HS code shown for Bms641 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Bms641, based on the data on this page

What is Bms641?

BMS641 (BMS-209641) is a selective RARbeta agonist.

What is the CAS number of Bms641?

The CAS registry number of Bms641 is 369364-50-1.

What is the molecular formula and weight of Bms641?

The molecular formula of Bms641 is C27H23ClO2 and its molar mass is 414.93 g/mol.

What is Bms641 used for?

Known uses and roles of Bms641 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Bms641 hazardous?

No GHS hazard classification for Bms641 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 Bms641?

Bms641 is usually classified under HS code 291639 (Aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bms641?

Post a free request on CompoundList and suppliers of Bms641 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Bms641?

Suppliers quote Bms641 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 Bms641

Get quotes for Bms641

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Bms641
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 Bms641 with a 3D view, its CAS number and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/bms641-369364-50-1" title="Bms641 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 291639

Price on request
Free quotes, contact stays private
Get quotes