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Screening compounds

ID 1229

Also known as 1-(4-Fluorophenyl)-4-(1,4,5,6-tetrahydro-8-hydroxy-6,11-dimethyl-2,6-methano-3-benzazocin-3(2H)-yl)-1-butanone, 2-(3-(4-Fluorobenzoyl)-1-propyl)-5alpha,9 alpha-dimethyl-2'-hydroxy-6,7-benzomorphan, 1-Butanone, 1-(4-fluorophenyl)-4-(1,4,5,6-tetrahydro-8-hydroxy-6,11-dimethyl-2,6-methano-3-benzazocin-3(2H)-yl)-

CAS 30802-84-7Formula C24H28FNO2Molar mass 381.49 g/mol
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ID 1229 chemical structure, C24H28FNO2, CAS 30802-84-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
30802-84-7
Formula
C24H28FNO2
Molar mass
381.49 g/mol
HS code
293399
Category
Screening compounds

What is ID 1229?

Plain description, key identifiers and synonyms

ID 1229 is a chemical substance with the molecular formula C24H28FNO2 and a molar mass of 381.49 g/mol. Its CAS registry number is 30802-84-7. The IUPAC name is 1-(4-fluorophenyl)-4-(4-hydroxy-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-10-yl)butan-1-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-(4-fluorophenyl)-4-(4-hydroxy-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-10-yl)butan-1-one
CAS number
30802-84-7 CAS number cross-checked
Molecular formula
C24H28FNO2
InChIKey
SMDNOEGDKSJRPV-UHFFFAOYSA-N
InChI
InChI=1S/C24H28FNO2/c1-16-22-14-18-7-10-20(27)15-21(18)24(16,2)11-13-26(22)12-3-4-23(28)17-5-8-19(25)9-6-17/h5-10,15-16,22,27H,3-4,11-14H2,1-2H3
SMILES (canonical and isomeric)
CC1C2CC3=C(C1(CCN2CCCC(=O)C4=CC=C(C=C4)F)C)C=C(C=C3)O

Synonyms

  • 1-(4-Fluorophenyl)-4-(1,4,5,6-tetrahydro-8-hydroxy-6,11-dimethyl-2,6-methano-3-benzazocin-3(2H)-yl)-1-butanone
  • 2-(3-(4-Fluorobenzoyl)-1-propyl)-5alpha,9 alpha-dimethyl-2'-hydroxy-6,7-benzomorphan
  • 1-Butanone, 1-(4-fluorophenyl)-4-(1,4,5,6-tetrahydro-8-hydroxy-6,11-dimethyl-2,6-methano-3-benzazocin-3(2H)-yl)-
  • 1-(4-Fluorophenyl)-4-(4-hydroxy-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-10-yl)butan-1-one
  • 1-(4-Fluorophenyl)-4-(8-hydroxy-6,11-dimethyl-1,4,5,6-tetrahydro-2,6-methano-3-benzazocin-3(2H)-yl)butan-1-one

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
381.49 g/molcalc.
Exact mass
381.2104 Dacalc.
LogP (octanol/water)
4.72calc.
Topological polar surface area
40.54 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
5calc.
Heavy atoms
28calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.46calc.
Formal charge
0calc.
Stereocentres
3calc.
Lipinski rule of five
Passes (0 violations)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, O=C(CCCN1CCC2CC1Cc1ccccc12)c1ccccc1

O=C(CCCN1CCC2CC1Cc1ccccc12)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.

ID 1229 suppliers

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ID 1229 price

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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 ID 1229 is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

The HS code shown for ID 1229 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about ID 1229, based on the data on this page

What is ID 1229?

ID 1229 is a chemical substance with the molecular formula C24H28FNO2 and a molar mass of 381.49 g/mol. Its CAS registry number is 30802-84-7. The IUPAC name is 1-(4-fluorophenyl)-4-(4-hydroxy-1,13-dimethyl-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-10-yl)butan-1-one.

What is the CAS number of ID 1229?

The CAS registry number of ID 1229 is 30802-84-7.

What is the molecular formula and weight of ID 1229?

The molecular formula of ID 1229 is C24H28FNO2 and its molar mass is 381.49 g/mol.

What is ID 1229 used for?

Known uses and roles of ID 1229 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is ID 1229 hazardous?

No GHS hazard classification for ID 1229 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 ID 1229?

ID 1229 is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy ID 1229?

Post a free request on CompoundList and suppliers of ID 1229 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of ID 1229?

Suppliers quote ID 1229 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 ID 1229

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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