CAS
91569-62-9 Purity
96%
91569-62-9 Purity
96%
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Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)-
CAS
915707-40-3
Catalog Number
ACM915707403
Category
Other Products
Molecular Weight
187.24
Molecular Formula
C11H13N3
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Specification
Synonyms
4-(1-Methyl-1H-pyrazol-3-yl)benzylamine, 915707-40-3, SureCN109785, CTK5G9823, MolPort-000-142-705, SBB090615, AKOS006343978, AG-H-75798, CC23813, RP03524, KB-237183, Y4684, [4-(1-methylpyrazol-3-yl)phenyl]methanamine, [4-(1-methylpyrazol-3-yl)phenyl]methylamine, 3-[4-(Aminomethyl)phenyl]-1-methyl-1H-pyrazole
IUPAC Name
[4-(1-methylpyrazol-3-yl)phenyl]methanamine
Canonical SMILES
CN1C=CC(=N1)C2=CC=C(C=C2)CN
InChI Key
ABWRSDPFKICMIH-UHFFFAOYSA-N
Boiling Point
346.6ºC at 760 mmHg
Flash Point
163.4ºC
Density
1.14g/cm³
Exact Mass
187.11100
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The molecular formula is C11H13N3.
When was Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl) created and last modified?
It was created on 2008-02-29 and last modified on 2023-12-30.
What is the IUPAC name of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The IUPAC name is [4-(1-methylpyrazol-3-yl)phenyl]methanamine.
What is the InChI of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The InChI is InChI=1S/C11H13N3/c1-14-7-6-11(13-14)10-4-2-9(8-12)3-5-10/h2-7H,8,12H2,1H3.
What is the molecular weight of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The molecular weight is 187.24 g/mol.
What is the Canonical SMILES of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The Canonical SMILES is CN1C=CC(=N1)C2=CC=C(C=C2)CN.
How many hydrogen bond donor counts does Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl) have?
It has 1 hydrogen bond donor count.
What is the XLogP3-AA value of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The XLogP3-AA value is 0.8.
What is the topological polar surface area of Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl)?
The topological polar surface area is 43.8 Ų.
Is Benzenemethanamine,4-(1-methyl-1H-pyrazol-3-yl) a canonicalized compound?
Yes, it is a canonicalized compound.
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