CAS
914347-67-4 Purity
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914347-67-4 Purity
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4-Piperidinol,1-(6-chloro-4-pyrimidinyl)-
CAS
914347-85-6
Catalog Number
ACM914347856
Category
Other Products
Molecular Weight
213.66
Molecular Formula
C9H12 Cl N3 O
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Specification
Synonyms
914347-85-6, 1-(6-Chloropyrimidin-4-yl)-4-piperidinol, 1-(6-chloro-4-pyrimidinyl)-4-piperidinol, 1-(6-Chloro-pyrimidin-4-yl)-piperidin-4-ol, 1-(6-chloropyrimidin-4-yl)piperidin-4-ol, PubChem15868, CTK8A0532, MolPort-002-052-647, ANW-44986, SBB075218, ZINC16678715, AKOS009103593, AB45708, AG-A-15443, AK-22125, KB-09418, 1-(6-Chloro-pyrimidin-4-yl)piperidin-4-ol, FT-0681427, 1-(6-chloranylpyrimidin-4-yl)piperidin-4-ol, A843914
IUPAC Name
1-(6-chloropyrimidin-4-yl)piperidin-4-ol
Canonical SMILES
C1CN(CCC1O)C2=CC(=NC=N2)Cl
InChI Key
WQFYOBVOGNPDNN-UHFFFAOYSA-N
Boiling Point
402.6ºC at 760 mmHg
Flash Point
197.3ºC
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-(6-chloro-4-pyrimidinyl)?
The molecular formula is C9H12ClN3O.
What is the molecular weight of 4-Piperidinol,1-(6-chloro-4-pyrimidinyl)?
The molecular weight is 213.66 g/mol.
When was 4-Piperidinol,1-(6-chloro-4-pyrimidinyl) created in PubChem?
It was created on 2007-12-05.
What is the IUPAC name of 4-Piperidinol,1-(6-chloro-4-pyrimidinyl)?
The IUPAC name is 1-(6-chloropyrimidin-4-yl)piperidin-4-ol.
What is the InChI of 4-Piperidinol,1-(6-chloro-4-pyrimidinyl)?
The InChI is InChI=1S/C9H12ClN3O/c10-8-5-9(12-6-11-8)13-3-1-7(14)2-4-13/h5-7,14H,1-4H2.
How many hydrogen bond donor counts does 4-Piperidinol,1-(6-chloro-4-pyrimidinyl) have?
It has one hydrogen bond donor count.
What is the topological polar surface area of 4-Piperidinol,1-(6-chloro-4-pyrimidinyl)?
The topological polar surface area is 49.2 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of 4-Piperidinol,1-(6-chloro-4-pyrimidinyl)?
The XLogP3-AA value is 1.5.
How many covalently-bonded unit counts does 4-Piperidinol,1-(6-chloro-4-pyrimidinyl) have?
It has one covalently-bonded unit count.
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