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Impurities and reference standards

Tri015

Also known as (2S)-2-(Adamantan-1-yl)-2-(((R)-2-hydroxy-1-phenylethyl)amino)acetonitrile, (2S)-2-(1-adamantyl)-2-[[(1R)-2-hydroxy-1-phenylethyl]amino]acetonitrile, Saxagliptin Impurity 24

CAS 361441-95-4Formula C20H26N2OMolar mass 310.44 g/mol
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Tri015 chemical structure, C20H26N2O, CAS 361441-95-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
361441-95-4
Formula
C20H26N2O
Molar mass
310.44 g/mol
HS code
292690
Category
Impurities and reference standards

What is Tri015?

Plain description, key identifiers and synonyms

Tri015 is a chemical substance with the molecular formula C20H26N2O and a molar mass of 310.44 g/mol. Its CAS registry number is 361441-95-4. The IUPAC name is (2S)-2-(1-adamantyl)-2-[[(1R)-2-hydroxy-1-phenylethyl]amino]acetonitrile.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S)-2-(1-adamantyl)-2-[[(1R)-2-hydroxy-1-phenylethyl]amino]acetonitrile
CAS number
361441-95-4 CAS number cross-checked
Molecular formula
C20H26N2O
MDL number
MFCD21606966
InChIKey
BRLUMYAYSUWXEL-HESWJOIASA-N
InChI
InChI=1S/C20H26N2O/c21-12-19(22-18(13-23)17-4-2-1-3-5-17)20-9-14-6-15(10-20)8-16(7-14)11-20/h1-5,14-16,18-19,22-23H,6-11,13H2/t14?,15?,16?,18-,19+,20?/m0/s1
Canonical SMILES
N#CC(NC(CO)c1ccccc1)C12CC3CC(CC(C3)C1)C2
Isomeric SMILES
C1C2CC3CC1CC(C2)(C3)[C@@H](C#N)N[C@@H](CO)C4=CC=CC=C4

Synonyms

  • (2S)-2-(Adamantan-1-yl)-2-(((R)-2-hydroxy-1-phenylethyl)amino)acetonitrile
  • (2S)-2-(1-adamantyl)-2-[[(1R)-2-hydroxy-1-phenylethyl]amino]acetonitrile
  • Saxagliptin Impurity 24
  • (S)-2-(Adamantan-1-yl)-2-[[(R)-2-hydroxy-1-phenylethyl]amino]acetonitrile
  • (S)-2-(adamantan-1-yl)-2-(((R)-2-hydroxy-1-phenylethyl)amino)acetonitrile
  • (2S)-2-(Adamantan-1-yl)-2-{[(1R)-2-hydroxy-1-phenylethyl]amino}acetonitrile
  • (2S)-(Adamantan-1-yl){[(1R)-2-hydroxy-1-phenylethyl]amino}acetonitrile
  • (S)-2-((3S,5S,7S)-adamantan-1-yl)-2-(((R)-2-hydroxy-1-phenylethyl)amino)acetonitrile
  • (S)-2-((3S,5S,7S)-Adamantan-1-yl)-2-(((R)-2-hydroxy-1-phenylethyl)amino)acetonitrile (Saxagliptin Impurity pound(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
310.44 g/molcalc.
Exact mass
310.2045 Dacalc.
LogP (octanol/water)
3.42calc.
Topological polar surface area
56.05 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
5calc.
Heavy atoms
23calc.
Rings
5calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.65calc.
Formal charge
0calc.
Stereocentres
2calc.
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, c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1

c1ccc(CNCC23CC4CC(CC(C4)C2)C3)cc1

5 rings, 19 atoms.

13 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.

Tri015 suppliers

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Tri015 price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 Tri015 is traded under.

HS 2926.90Indicative HS code

Nitrile-function compounds, other

World exports in 2024
$2.15B
−13.5% vs 2023, imports $2.17B
2019 to 2024
Top exporters
  1. China35.6%
  2. France * partner reported12.7%
  3. India * partner reported11.2%
Top importers
  1. United States13.6%
  2. China12.4%
  3. Brazil11.9%

* Partner reported figures, a lower bound.

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

The HS code shown for Tri015 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Tri015, based on the data on this page

What is Tri015?

Tri015 is a chemical substance with the molecular formula C20H26N2O and a molar mass of 310.44 g/mol. Its CAS registry number is 361441-95-4. The IUPAC name is (2S)-2-(1-adamantyl)-2-[[(1R)-2-hydroxy-1-phenylethyl]amino]acetonitrile.

What is the CAS number of Tri015?

The CAS registry number of Tri015 is 361441-95-4.

What is the molecular formula and weight of Tri015?

The molecular formula of Tri015 is C20H26N2O and its molar mass is 310.44 g/mol.

Is Tri015 hazardous?

No GHS hazard classification for Tri015 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 Tri015?

Tri015 is usually classified under HS code 292690 (Nitrile-function compounds, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Tri015?

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What is the price of Tri015?

Suppliers quote Tri015 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 Tri015

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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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