4-[5-(Trifluoromethyl)pyridin-2-yl]benzylamine

CAS
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CAS
906352-74-7
Size
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Purity
96%
Price
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Availability
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Catalog Number

ACM906352747

Product Name

4-[5-(Trifluoromethyl)pyridin-2-yl]benzylamine

Structure

Structure

CAS

906352-74-7

Category

Heterocyclic Organic Compound

Synonyms

4-[5-(Trifluoromethyl)pyridin-2-yl]benzylamine, 906352-74-7, CTK5G8220, MolPort-000-143-627, SBB101097, AG-H-71948, CC53013, KB-63759, {4-[5-(trifluoromethyl)-2-pyridyl]phenyl}methylamine, {4-[5-(trifluoromethyl)pyrid-2-yl]phenyl}methylamine, {4-[5-(trifluoromethyl)pyridin-2-yl]phenyl}methanamine, 2-[4-(Aminomethyl)phenyl]-5-(trifluoromethyl)pyridine, 4-[5-(TRIFLUOROMETHYL)(PYRIDIN-2-YL)]BENZYLAMINE

IUPAC Name

[4-[5-(trifluoromethyl)pyridin-2-yl]phenyl]methanamine

Molecular Weight

252.235

Molecular Formula

C₁₃H₁₁F₃N₂

Canonical SMILES

C1=CC(=CC=C1CN)C2=NC=C(C=C2)C(F)(F)F

InChI Key

XQAJYHFQYZEWSE-UHFFFAOYSA-N

Boiling Point

330ºC at 760 mmHg

Melting Point

108.5-110ºC

Flash Point

153.4ºC

Density

1.252g/cm³

Exact Mass

252.08700

H-Bond Acceptor

5

H-Bond Donor

1

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The molecular formula is C13H11F3N2.

What is the molecular weight of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The molecular weight is 252.23 g/mol.

What is the IUPAC name of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The IUPAC name is [4-[5-(trifluoromethyl)pyridin-2-yl]phenyl]methanamine.

What is the InChI of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The InChI is InChI=1S/C13H11F3N2/c14-13(15,16)11-5-6-12(18-8-11)10-3-1-9(7-17)2-4-10/h1-6,8H,7,17H2.

What is the InChIKey of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The InChIKey is XQAJYHFQYZEWSE-UHFFFAOYSA-N.

What is the Canonical SMILES of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The Canonical SMILES is C1=CC(=CC=C1CN)C2=NC=C(C=C2)C(F)(F)F.

What is the CAS number of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The CAS number is 906352-74-7.

How many hydrogen bond donor counts are there in {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

There is 1 hydrogen bond donor count.

What is the topological polar surface area of {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine?

The topological polar surface area is 38.9 Å².

Is {4-[5-(Trifluoromethyl)pyrid-2-yl]phenyl}methylamine a canonicalized compound?

Yes, it is canonicalized according to PubChem.

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