CAS
20358-03-6 Purity
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20358-03-6 Purity
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5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde
CAS
1188037-62-8
Catalog Number
ACM1188037628
Category
Bromine Series
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What is the molecular formula of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The molecular formula is C14H15BrN2O.
What is the molecular weight of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The molecular weight is 307.19 g/mol.
What is the IUPAC Name of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The IUPAC Name is 5-bromo-3-(2-methylpropyl)-1-phenylpyrazole-4-carbaldehyde.
What is the InChI of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The InChI is InChI=1S/C14H15BrN2O/c1-10(2)8-13-12(9-18)14(15)17(16-13)11-6-4-3-5-7-11/h3-7,9-10H,8H2,1-2H3.
What is the InChIKey of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The InChIKey is AZAYWWKYUOVUFQ-UHFFFAOYSA-N.
What is the Canonical SMILES of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The Canonical SMILES is CC(C)CC1=NN(C(=C1C=O)Br)C2=CC=CC=C2.
What is the CAS number of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The CAS number is 1188037-62-8.
What is the XLogP3-AA value of 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde?
The XLogP3-AA value is 4.
How many hydrogen bond donor count does 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde have?
It has 0 hydrogen bond donor count.
How many hydrogen bond acceptor count does 5-Bromo-3-isobutyl-1-phenyl-1H-pyrazole-4-carbaldehyde have?
It has 2 hydrogen bond acceptor count.
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