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Isotope-labelled compounds

Nitrendipine-d5

Also known as 3-O-methyl 5-O-(1,1,2,2,2-pentadeuterioethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

CAS 2469554-26-3Formula C18H20N2O6Molar mass 365.40 g/mol
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Nitrendipine-d5 chemical structure, C18H20N2O6, CAS 2469554-26-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2469554-26-3
Formula
C18H20N2O6
Molar mass
365.40 g/mol
HS code
284590
Category
Isotope-labelled compounds

What is Nitrendipine-d5?

Plain description, key identifiers and synonyms

Nitrendipine-d5 is a chemical substance with the molecular formula C18H20N2O6 and a molar mass of 365.40 g/mol. Its CAS registry number is 2469554-26-3. The IUPAC name is 3-O-methyl 5-O-(1,1,2,2,2-pentadeuterioethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-O-methyl 5-O-(1,1,2,2,2-pentadeuterioethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
CAS number
2469554-26-3
Molecular formula
C18H20N2O6
InChIKey
PVHUJELLJLJGLN-RPIBLTHZSA-N
InChI
InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3/i1D3,5D2
Canonical SMILES
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1
Isomeric SMILES
[2H]C([2H])([2H])C([2H])([2H])OC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C

Synonyms

  • 3-O-methyl 5-O-(1,1,2,2,2-pentadeuterioethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

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
365.40 g/molcalc.
Exact mass
365.1635 Dacalc.
LogP (octanol/water)
2.57calc.
Topological polar surface area
107.8 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
5calc.
Heavy atoms
26calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
1calc.
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, C1=CC(c2ccccc2)C=CN1

C1=CC(c2ccccc2)C=CN1

2 rings, 12 atoms.

669 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.

Nitrendipine-d5 suppliers

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Nitrendipine-d5 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 Nitrendipine-d5 is traded under.

HS 2845.90Indicative HS code

Compounds, inorganic or organic, of such isotopes, whether or not chemically defined

World exports in 2024
$2.67B
+19.0% vs 2023, imports $1.67B
2019 to 2024
Top exporters
  1. Ireland55.3%
  2. Hong Kong11.8%
  3. United States10.7%
Top importers
  1. China24.3%
  2. Ireland21.9%
  3. South Korea13.3%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Nitrendipine-d5 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Nitrendipine-d5, based on the data on this page

What is Nitrendipine-d5?

Nitrendipine-d5 is a chemical substance with the molecular formula C18H20N2O6 and a molar mass of 365.40 g/mol. Its CAS registry number is 2469554-26-3. The IUPAC name is 3-O-methyl 5-O-(1,1,2,2,2-pentadeuterioethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.

What is the CAS number of Nitrendipine-d5?

The CAS registry number of Nitrendipine-d5 is 2469554-26-3.

What is the molecular formula and weight of Nitrendipine-d5?

The molecular formula of Nitrendipine-d5 is C18H20N2O6 and its molar mass is 365.40 g/mol.

What is Nitrendipine-d5 used for?

Known uses and roles of Nitrendipine-d5 include isotope-labelled compounds in research and laboratory.

Is Nitrendipine-d5 hazardous?

No GHS hazard classification for Nitrendipine-d5 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 Nitrendipine-d5?

Nitrendipine-d5 is usually classified under HS code 284590 (Isotopes other than those of heading 2844, compounds, inorganic or organic, of such…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Nitrendipine-d5?

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What is the price of Nitrendipine-d5?

Suppliers quote Nitrendipine-d5 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

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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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