3-Pyrimidin-2-ylbenzylamine

• CAS: 910036-92-9
• Catalog Number: ACM910036929
• Category: Other Products
• Molecular Weight: 185.22514
• Molecular Formula: C₁₁H₁₁N₃
• Synonyms: 3-Pyrimidin-2-ylbenzylamine;3-Pyrimidin-2-ylbenzylamine 97%;(3-(pyriMidin-2-yl)phenyl)MethanaMine;3-(Pyrimidin-2-yl)benzylamine97%
• IUPAC Name: (3-pyrimidin-2-ylphenyl)methanamine
• Canonical SMILES: C1=CC(=CC(=C1)CN)C2=NC=CC=N2
• InChI Key: MXSXDKVANPZCBQ-UHFFFAOYSA-N
• Boiling Point: 270.2ºC at 760 mmHg
• Flash Point: 141.5ºC
• Density: 1.149g/cm³
• Exact Mass: 185.09500
• Hazard Statements: C,T
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Safety Description: 45

Custom Q&A

What is the molecular formula of 3-Pyrimidin-2-ylbenzylamine?

The molecular formula of 3-Pyrimidin-2-ylbenzylamine is C11H11N3.

When was the structure of 3-Pyrimidin-2-ylbenzylamine created and modified?

The structure of 3-Pyrimidin-2-ylbenzylamine was created on 2008-02-29 and modified on 2023-12-30.

What is the molecular weight of 3-Pyrimidin-2-ylbenzylamine?

The molecular weight of 3-Pyrimidin-2-ylbenzylamine is 185.22 g/mol.

What is the IUPAC name of 3-Pyrimidin-2-ylbenzylamine?

The IUPAC name of 3-Pyrimidin-2-ylbenzylamine is (3-pyrimidin-2-ylphenyl)methanamine.

What is the InChI key for 3-Pyrimidin-2-ylbenzylamine?

The InChI key for 3-Pyrimidin-2-ylbenzylamine is MXSXDKVANPZCBQ-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 3-Pyrimidin-2-ylbenzylamine have?

3-Pyrimidin-2-ylbenzylamine has 1 hydrogen bond donor count.

What is the XLogP3-AA value for 3-Pyrimidin-2-ylbenzylamine?

The XLogP3-AA value for 3-Pyrimidin-2-ylbenzylamine is 0.7.

What is the topological polar surface area of 3-Pyrimidin-2-ylbenzylamine?

The topological polar surface area of 3-Pyrimidin-2-ylbenzylamine is 51.8 Å^2.

How many rotatable bond counts does 3-Pyrimidin-2-ylbenzylamine have?

3-Pyrimidin-2-ylbenzylamine has 2 rotatable bond counts.

Is 3-Pyrimidin-2-ylbenzylamine a canonicalized compound?

Yes, 3-Pyrimidin-2-ylbenzylamine is a canonicalized compound.