CAS
934570-42-0 Purity
96%
934570-42-0 Purity
96%
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Benzenemethanamine,3-(1-methyl-1H-pyrazol-5-yl)-
CAS
934570-45-3
Catalog Number
ACM934570453
Category
Other Products
Molecular Weight
187.24
Molecular Formula
C11H13N3
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Specification
Synonyms
934570-45-3, 3-(1-Methyl-1H-pyrazol-5-yl)benzylamine, SureCN112291, CTK5H2532, MolPort-000-143-872, SBB090613, AKOS013154319, AG-H-82037, CC60513, AK122071, KB-88225, [3-(1-methylpyrazol-5-yl)phenyl]methylamine, [3-(2-methylpyrazol-3-yl)phenyl]methanamine, (3-(1-Methyl-1H-pyrazol-5-yl)phenyl)methanamine, [3-(1-Methyl-1H-pyrazol-5-yl)phenyl]methylamine, I01-19434
IUPAC Name
[3-(2-methylpyrazol-3-yl)phenyl]methanamine
Canonical SMILES
CN1C(=CC=N1)C2=CC(=CC=C2)CN
InChI Key
UPQOTZRZQXMJNT-UHFFFAOYSA-N
Boiling Point
341.4ºC at 760 mmHg
Flash Point
160.3ºC
Density
1.14g/cm³
Exact Mass
187.11100
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
The molecular formula is C11H13N3.
When was Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl) created and last modified according to PubChem?
It was created on February 29, 2008, and last modified on December 30, 2023.
What is the IUPAC name of Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
The IUPAC name is [3-(2-methylpyrazol-3-yl)phenyl]methanamine.
What is the InChI of Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
The InChI is InChI=1S/C11H13N3/c1-14-11(5-6-13-14)10-4-2-3-9(7-10)8- 12/h2-7H,8,12H2,1H3.
What is the molecular weight of Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
The molecular weight is 187.24 g/mol.
How many hydrogen bond donor counts does Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl) have?
It has 1 hydrogen bond donor count.
What is the XLogP3-AA value of Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
The XLogP3-AA value is 0.8.
What is the topological polar surface area of Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
The topological polar surface area is 43.8 Å^2.
How many heavy atoms are present in Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl)?
There are 14 heavy atoms in the compound.
Is the compound Benzenemethanamine, 3-(1-methyl-1H-pyrazol-5-yl) canonicalized?
Yes, the compound is canonicalized.
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