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Isotope-labelled compounds

Npc214776

Also known as p-Anisaldehyde-|A-d1, deuterio-(4-methoxyphenyl)methanone, 4-Methoxybenzaldehyde-alpha-d1

CAS 19486-71-6Formula C8H8O2Molar mass 137.16 g/molEC 686-084-5
GHS signal word: Warning. Pictograms: Harmful or irritant
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Npc214776 chemical structure, C8H8O2, CAS 19486-71-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
19486-71-6
Formula
C8H8O2
Molar mass
137.16 g/mol
EC number
686-084-5
HS code
284590
Category
Isotope-labelled compounds

What is Npc214776?

Plain description, key identifiers and synonyms

Npc214776 is a chemical substance with the molecular formula C8H8O2 and a molar mass of 137.16 g/mol. Its CAS registry number is 19486-71-6. The IUPAC name is deuterio-(4-methoxyphenyl)methanone.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
deuterio-(4-methoxyphenyl)methanone
CAS number
19486-71-6 CAS number cross-checked
EC number
686-084-5
Molecular formula
C8H8O2
InChIKey
ZRSNZINYAWTAHE-RAMDWTOOSA-N
InChI
InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3/i6D
Canonical SMILES
COc1ccc(C=O)cc1
Isomeric SMILES
[2H]C(=O)C1=CC=C(C=C1)OC

Synonyms

  • p-Anisaldehyde-|A-d1
  • deuterio-(4-methoxyphenyl)methanone
  • 4-Methoxybenzaldehyde-alpha-d1
  • 4-Methoxybenzaldehyde-d1
  • p-Anisaldehyde-
  • A-d1
  • 4-Methoxybenzaldehyde-?-d1
  • 4-Methoxy(formyl-~2~H)benzaldehyde
  • 4-Methoxybenzaldehyde-alpha-d1, 98 atom % D

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
137.16 g/molcalc.
Exact mass
137.0587 Dacalc.
LogP (octanol/water)
1.51calc.
Topological polar surface area
26.3 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
2calc.
Heavy atoms
10calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.13calc.
Formal charge
0calc.
Stereocentres
0calc.
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, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302Harmful if swallowed.
  • H315Causes skin irritation.
  • H319Causes serious eye irritation.
  • H335May cause respiratory irritation.
Precautionary statements (19)
  • P261Avoid breathing dust, fume, gas, mist, vapours or spray.
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P270Do not eat, drink or smoke when using this product.
  • P271Use only outdoors or in a well-ventilated area.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P317If swallowed: Get medical help.
  • P302 + P352If on skin: Wash with plenty of water.
  • P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P319Get medical help if you feel unwell.
  • P321Specific treatment (see supplemental first aid instructions on the label).
  • P330Rinse mouth.
  • P332 + P317If skin irritation occurs: Get medical help.
  • P337 + P317If eye irritation persists: Get medical help.
  • P362 + P364Take off contaminated clothing. And wash it before reuse.
  • P403 + P233Store in a well-ventilated place. Keep container tightly closed.
  • P405Store locked up.
  • P501Dispose of contents and container in accordance with local regulations.

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

Full safety data and first aid

Npc214776 suppliers

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Npc214776 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

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 Npc214776 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 Npc214776 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Npc214776, based on the data on this page

What is Npc214776?

Npc214776 is a chemical substance with the molecular formula C8H8O2 and a molar mass of 137.16 g/mol. Its CAS registry number is 19486-71-6. The IUPAC name is deuterio-(4-methoxyphenyl)methanone.

What is the CAS number of Npc214776?

The CAS registry number of Npc214776 is 19486-71-6.

What is the molecular formula and weight of Npc214776?

The molecular formula of Npc214776 is C8H8O2 and its molar mass is 137.16 g/mol.

What is Npc214776 used for?

Known uses and roles of Npc214776 include isotope-labelled compounds in research and laboratory.

Is Npc214776 hazardous?

Npc214776 carries the GHS signal word "Warning". Main hazards: harmful if swallowed, causes skin irritation, causes serious eye irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Npc214776?

Npc214776 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 Npc214776?

Post a free request on CompoundList and suppliers of Npc214776 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Npc214776?

Suppliers quote Npc214776 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 Npc214776

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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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