N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine

CAS
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CAS
914260-86-9
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Purity
96%
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Catalog Number

ACM914260869

Product Name

N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine

Structure

Structure

CAS

914260-86-9

Category

Heterocyclic Organic Compound

Synonyms

N-(tetrahydro-2H-pyran-4-ylmethyl)ethanamine, 914260-86-9, ethyl(oxan-4-ylmethyl)amine, SureCN4572204, CTK5G9598, MolPort-006-067-186, ALBB-005318, SBB047754, STK503346, AKOS005171515, AG-H-75196, N-(Tetrahydro-2H-pyran-4-ylmethyl)ethylamine

IUPAC Name

N-(oxan-4-ylmethyl)ethanamine

Molecular Weight

143.226680 [g/mol]

Molecular Formula

C₈H₁₇NO

Canonical SMILES

CCNCC1CCOCC1

InChI Key

SPIBNYIRDDCSOO-UHFFFAOYSA-N

Exact Mass

143.13100

H-Bond Acceptor

2

H-Bond Donor

1

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The molecular formula is C8H17NO.

What is the molecular weight of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The molecular weight is 143.23 g/mol.

What is the IUPAC name of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The IUPAC name is N-(oxan-4-ylmethyl)ethanamine.

What is the InChI of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The InChI is InChI=1S/C8H17NO/c1-2-9-7-8-3-5-10-6-4-8/h8-9H,2-7H2,1H3.

What is the InChIKey of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The InChIKey is SPIBNYIRDDCSOO-UHFFFAOYSA-N.

What is the Canonical SMILES of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The Canonical SMILES is CCNCC1CCOCC1.

What is the XLogP3-AA value of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The XLogP3-AA value is 0.8.

How many hydrogen bond donor counts does N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine have?

N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine has 1 hydrogen bond donor count.

What is the topological polar surface area of N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine?

The topological polar surface area is 21.3 Å².

Is N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine a canonicalized compound according to PubChem?

Yes, N-(Tetrahydro-2H-pyran-4-ylmethyl)ethanamine is a canonicalized compound.

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