CAS
91642-97-6 Purity
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91642-97-6 Purity
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Ethanone,1-[4-(2-aminophenyl)-1-piperazinyl]-
CAS
91646-45-6
Catalog Number
ACM91646456
Category
Other Products
Molecular Weight
219.282880 [g/mol]
Molecular Formula
C12H17N3O
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Specification
Synonyms
91646-45-6, 2-(4-acetyl-piperazin-1-yl)aniline, 1-(4-(2-aminophenyl)piperazin-1-yl)ethanone, 1-[4-(2-aminophenyl)piperazin-1-yl]ethanone, 1-[4-(2-Amino-phenyl)-piperazin-1-yl]-ethanone, 1-acetyl-4-(2-aminophenyl)piperazine, AG-H-76399, BAS 07246388, ZINC00533049, PubChem12187, AC1LIU23, CTK3I5707, MolPort-000-823-670, BB_SC-0890, HMS1692N14, 2-(4-acetylpiperazin-1-yl)aniline, ANW-46511, BBL000153, STK141970, AKOS000103431
IUPAC Name
1-[4-(2-aminophenyl)piperazin-1-yl]ethanone
InChI Key
PRAAXUFHOPUWRQ-UHFFFAOYSA-N
Boiling Point
427.3ºC at 760 mmHg
Flash Point
212.2ºC
Density
1.177g/cm³
Exact Mass
219.13700
H-Bond Acceptor
3
H-Bond Donor
1
What is the IUPAC name of the compound?
The IUPAC name of the compound is 1-[4-(2-aminophenyl)piperazin-1-yl]ethanone.
What is the molecular formula of the compound?
The molecular formula of the compound is C12H17N3O.
What is the molecular weight of the compound?
The molecular weight of the compound is 219.28 g/mol.
What is the CAS number of the compound?
The CAS number of the compound is 91646-45-6.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C12H17N3O/c1-10(16)14-6-8-15(9-7-14)12-5-3-2-4-11(12)13/h2-5H,6-9,13H2,1H3.
What is the InChIKey of the compound?
The InChIKey of the compound is PRAAXUFHOPUWRQ-UHFFFAOYSA-N.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 0.6.
How many hydrogen bond donor atoms are there in the compound?
There is 1 hydrogen bond donor atom in the compound.
How many hydrogen bond acceptor atoms are there in the compound?
There are 3 hydrogen bond acceptor atoms in the compound.
How many rotatable bonds are there in the compound?
There is 1 rotatable bond in the compound.
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