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Cyclohexanamine, 3-(phenylmethoxy)-, cis-

Also known as (1S,3R)-3-(Benzyloxy)cyclohexan-1-amine

CAS 98454-40-1Formula C13H19NOMolar mass 205.30 g/mol
Cyclohexanamine, 3-(phenylmethoxy)-, cis- chemical structure, C13H19NO, CAS 98454-40-1
2D chemical structure

Key facts

What buyers check first

CAS number
98454-40-1
Formula
C13H19NO
Molar mass
205.30 g/mol
HS code
292219
Category
Aromatic building blocks

What is Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

Plain description, key identifiers and synonyms

Cyclohexanamine, 3-(phenylmethoxy)-, cis- is a chemical substance with the molecular formula C13H19NO and a molar mass of 205.30 g/mol. Its CAS registry number is 98454-40-1. The IUPAC name is cis-(1S,3R)-3-phenylmethoxycyclohexan-1-amine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
cis-(1S,3R)-3-phenylmethoxycyclohexan-1-amine
CAS number
98454-40-1
Molecular formula
C13H19NO
InChIKey
ZJXHVYNFOOHLNB-QWHCGFSZSA-N
InChI
InChI=1S/C13H19NO/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,7-10,14H2/t12-,13+/m0/s1
Canonical SMILES
NC1CCCC(OCc2ccccc2)C1
Isomeric SMILES
C1C[C@@H](C[C@@H](C1)OCC2=CC=CC=C2)N

Synonyms

  • (1S,3R)-3-(Benzyloxy)cyclohexan-1-amine

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
205.30 g/molcalc.
Exact mass
205.1467 Dacalc.
LogP (octanol/water)
2.47calc.
Topological polar surface area
35.25 ร…ยฒcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
3calc.
Heavy atoms
15calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.54calc.
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(COC2CCCCC2)cc1

c1ccc(COC2CCCCC2)cc1

2 rings, 14 atoms, the Benzene, ((cyclohexyloxy)methyl)- ring system.

161 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.

Cyclohexanamine, 3-(phenylmethoxy)-, cis- suppliers

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Cyclohexanamine, 3-(phenylmethoxy)-, cis- 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 Cyclohexanamine, 3-(phenylmethoxy)-, cis- is traded under.

HS 2922.19Indicative HS code

Amino-alcohols, other than those containing more than one kind of oxygen function, theirโ€ฆ

World exports in 2024
$2.2B
โˆ’4.7% vs 2023, imports $2.27B
2019 to 2024
Top exporters
  1. China21.7%
  2. Germany17.3%
  3. United States15.6%
Top importers
  1. India * partner reported11.0%
  2. United States9.0%
  3. Germany7.2%

* Partner reported figures, a lower bound.

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

The HS code shown for Cyclohexanamine, 3-(phenylmethoxy)-, cis- is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Cyclohexanamine, 3-(phenylmethoxy)-, cis-, based on the data on this page

What is Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

Cyclohexanamine, 3-(phenylmethoxy)-, cis- is a chemical substance with the molecular formula C13H19NO and a molar mass of 205.30 g/mol. Its CAS registry number is 98454-40-1. The IUPAC name is cis-(1S,3R)-3-phenylmethoxycyclohexan-1-amine.

What is the CAS number of Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

The CAS registry number of Cyclohexanamine, 3-(phenylmethoxy)-, cis- is 98454-40-1.

What is the molecular formula and weight of Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

The molecular formula of Cyclohexanamine, 3-(phenylmethoxy)-, cis- is C13H19NO and its molar mass is 205.30 g/mol.

What is Cyclohexanamine, 3-(phenylmethoxy)-, cis- used for?

Known uses and roles of Cyclohexanamine, 3-(phenylmethoxy)-, cis- include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Cyclohexanamine, 3-(phenylmethoxy)-, cis- hazardous?

No GHS hazard classification for Cyclohexanamine, 3-(phenylmethoxy)-, cis- 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 Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

Cyclohexanamine, 3-(phenylmethoxy)-, cis- is usually classified under HS code 292219 (Amino-alcohols, other than those containing more than one kind of oxygen function, theirโ€ฆ). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

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What is the price of Cyclohexanamine, 3-(phenylmethoxy)-, cis-?

Suppliers quote Cyclohexanamine, 3-(phenylmethoxy)-, cis- 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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