CAS
907972-53-6 Purity
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907972-53-6 Purity
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5-Phenyl-2-piperazinone
CAS
907973-15-3
Catalog Number
ACM907973153
Category
Other Products
Molecular Weight
176.215080 [g/mol]
Molecular Formula
C10H12N2O
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Specification
Synonyms
5-phenylpiperazin-2-one, AGN-PC-01MKSN, SureCN12549784, 5-PHENYL-2-PIPERAZINONE, 5-PHENYL-PIPERAZIN-2-ONE, AKOS006284345, AB37265, 907973-15-3
IUPAC Name
5-phenylpiperazin-2-one
Canonical SMILES
C1C(NCC(=O)N1)C2=CC=CC=C2
InChI Key
RMZGIXQVAQTNNP-UHFFFAOYSA-N
Exact Mass
176.09500
H-Bond Acceptor
2
H-Bond Donor
2
What is the molecular formula of 5-Phenyl-2-piperazinone?
The molecular formula of 5-Phenyl-2-piperazinone is C10H12N2O.
What is the molecular weight of 5-Phenyl-2-piperazinone?
The molecular weight of 5-Phenyl-2-piperazinone is 176.21 g/mol.
What are some synonyms for 5-Phenyl-2-piperazinone?
Some synonyms for 5-Phenyl-2-piperazinone include 5-phenylpiperazin-2-one, (S)-5-phenylpiperazin-2-one, and 5-phenyl-piperazin-2-one.
What is the InChIKey for 5-Phenyl-2-piperazinone?
The InChIKey for 5-Phenyl-2-piperazinone is RMZGIXQVAQTNNP-UHFFFAOYSA-N.
What is the Canonical SMILES representation of 5-Phenyl-2-piperazinone?
The Canonical SMILES representation of 5-Phenyl-2-piperazinone is C1C(NCC(=O)N1)C2=CC=CC=C2.
What is the XLogP3-AA value for 5-Phenyl-2-piperazinone?
The XLogP3-AA value for 5-Phenyl-2-piperazinone is 0.4.
How many hydrogen bond donor counts does 5-Phenyl-2-piperazinone have?
5-Phenyl-2-piperazinone has 2 hydrogen bond donor counts.
How many rotatable bond counts does 5-Phenyl-2-piperazinone have?
5-Phenyl-2-piperazinone has 1 rotatable bond count.
What is the topological polar surface area of 5-Phenyl-2-piperazinone?
The topological polar surface area of 5-Phenyl-2-piperazinone is 41.1 Å2.
Is 5-Phenyl-2-piperazinone a canonicalized compound?
Yes, 5-Phenyl-2-piperazinone is a canonicalized compound.
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