CAS
91678-86-3 Purity
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91678-86-3 Purity
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4-Piperidinol,1-(4-chloro-2-pyrimidinyl)-
CAS
916791-08-7
Catalog Number
ACM916791087
Category
Other Products
Molecular Weight
213.66408
Molecular Formula
C9H12 Cl N3 O
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Specification
Synonyms
1-(4-CHLORO-PYRIMIDIN-2-YL)-PIPERIDIN-4-OL;1-(4-CHLOROPYRIMIDIN-2-YL)-4-PIPERIDINOL;2-(4-HYDROXYPIPERIDIN-1-YL)-4-CHLOROPYRIMIDINE
IUPAC Name
1-(4-chloropyrimidin-2-yl)piperidin-4-ol
Canonical SMILES
C1CN(CCC1O)C2=NC=CC(=N2)Cl
InChI Key
ZIFNBFBGRRTLNQ-UHFFFAOYSA-N
Boiling Point
398.5ºC at 760 mmHg
Flash Point
194.8ºC
Density
1.36g/cm³
Exact Mass
213.06700
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The molecular formula is C9H12ClN3O.
What are the synonyms of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The synonyms include 1-(4-Chloropyrimidin-2-yl)-4-piperidinol, 916791-08-7, and 1-(4-chloropyrimidin-2-yl)piperidin-4-ol.
What is the molecular weight of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The molecular weight is 213.66 g/mol.
What is the IUPAC name of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The IUPAC name is 1-(4-chloropyrimidin-2-yl)piperidin-4-ol.
What is the InChI of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The InChI is InChI=1S/C9H12ClN3O/c10-8-1-4-11-9(12-8)13-5-2-7(14)3-6-13/h1,4,7,14H,2-3,5-6H2.
What is the InChIKey of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The InChIKey is ZIFNBFBGRRTLNQ-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The canonical SMILES is C1CN(CCC1O)C2=NC=CC(=N2)Cl.
What is the CAS number of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The CAS number is 916791-08-7.
What is the XLogP3-AA property value of 4-Piperidinol,1-(4-chloro-2-pyrimidinyl)?
The XLogP3-AA property value is 1.5.
Is 4-Piperidinol,1-(4-chloro-2-pyrimidinyl) a canonicalized compound?
Yes, it is a canonicalized compound.
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