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Aliphatic and alicyclic building blocks

Npc236271

Also known as bornesitol, (-)-bornesitol, 1D-1-O-Methyl-myo-inositol

CAS 484-71-9Formula C7H14O6Molar mass 194.18 g/mol
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Npc236271 chemical structure, C7H14O6, CAS 484-71-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
484-71-9
Formula
C7H14O6
Molar mass
194.18 g/mol
HS code
290949
Category
Aliphatic and alicyclic building blocks

What is Npc236271?

Plain description, key identifiers and synonyms

1D-1-O-methyl-myo-inositol is a member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2R,3S,4S,5R,6S-isomer). It has a role as a plant metabolite.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1R,2S,4R,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
CAS number
484-71-9 CAS number cross-checkedOther or deprecated CAS: 58769-21-4
Molecular formula
C7H14O6
UNII
RW8AP5YP8U
InChIKey
DSCFFEYYQKSRSV-DQUUFWEPSA-N
InChI
InChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2?,3-,4+,5-,6-,7?/m1/s1
Canonical SMILES
COC1C(O)C(O)C(O)C(O)C1O
Isomeric SMILES
COC1[C@@H]([C@H](C([C@H]([C@H]1O)O)O)O)O

Synonyms

  • bornesitol
  • (-)-bornesitol
  • 1D-1-O-Methyl-myo-inositol
  • D-(-)-bornesitol
  • D-bornesitol
  • 1-o-methyl-d-myo-inositol
  • Bornesitol, (-)-
  • 1-O-Methyl-myo-inositol
  • D-Myo-inositol, 1-O-methyl-
  • Inositol, 1-O-methyl-, D-myo-
  • (1R,2R,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
  • (1R,2R,3S,4S,5R,6S)-6-methoxycyclohexane-1,2,3,4,5-pentol
  • D-1-O-Methyl-myo-inositol
  • (1R,2S,4R,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
  • (1R,2R,3S,4S,5R,6R)-6-Methoxycyclohexane-1,2,3,4,5-pentaol

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
194.18 g/molcalc.
Exact mass
194.079 Dacalc.
LogP (octanol/water)
-3.18calc.
Topological polar surface area
110.4 Ųcalc.
Hydrogen bond donors
5calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
1calc.
Heavy atoms
13calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
Formal charge
0calc.
Stereocentres
6calc.
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 Cyclohexane ring system.

24,737 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.

Npc236271 suppliers

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Npc236271 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

Roles

  • eukaryotic metabolite
  • metabolite
  • plant metabolite

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 Npc236271 is traded under.

HS 2909.49Indicative HS code

Ether-alcohols and their halogenated not elsewhere classified in subheading 2909.4

World exports in 2024
$1.74B
+6.8% vs 2023, imports $1.86B
2019 to 2024
Top exporters
  1. Germany20.6%
  2. China13.9%
  3. Netherlands12.2%
Top importers
  1. China8.8%
  2. Germany8.3%
  3. United States7.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Npc236271 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Npc236271, based on the data on this page

What is Npc236271?

1D-1-O-methyl-myo-inositol is a member of the class of methyl myo-inositols that is cyclohexane-1,2,3,4,5-pentol substituted by a methoxy group at position 6 (the 1R,2R,3S,4S,5R,6S-isomer). It has a role as a plant metabolite.

What is the CAS number of Npc236271?

The CAS registry number of Npc236271 is 484-71-9. Other or deprecated CAS numbers: 58769-21-4.

What is the molecular formula and weight of Npc236271?

The molecular formula of Npc236271 is C7H14O6 and its molar mass is 194.18 g/mol.

What is Npc236271 used for?

Known uses and roles of Npc236271 include building blocks in research and laboratory, screening compounds in research and laboratory, eukaryotic metabolite, metabolite and plant metabolite.

Is Npc236271 hazardous?

No GHS hazard classification for Npc236271 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 Npc236271?

Npc236271 is usually classified under HS code 290949 (Ether-alcohols and their halogenated, sulphonated, nitrated or nitrosated derivatives…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Npc236271?

Post a free request on CompoundList and suppliers of Npc236271 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Npc236271?

Suppliers quote Npc236271 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 Npc236271

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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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