CAS
902836-74-2 Purity
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902836-74-2 Purity
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2-Chloro-4-(3-piperidinyloxy)benzonitrile
CAS
902836-92-4
Catalog Number
ACM902836924
Category
Other Products
Molecular Weight
236.70
Molecular Formula
C12H13ClN2O
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Specification
Synonyms
2-CHLORO-4-(3-PIPERIDINYLOXY)BENZONITRILE, ST50407783, 902836-92-4, AC1Q3IGU, ACMC-20ao02, CTK7C8188, AKOS009460924, AG-A-39700, MCULE-7966113268, KB-229528, 2-chloro-4-(3-piperidyloxy)benzenecarbonitrile, 2-Chloro-4-(Piperidin-3-Yl-Oxy)-Benzonitrile
IUPAC Name
2-chloro-4-piperidin-3-yloxybenzonitrile
InChI Key
GPGZXKBRTANYCD-UHFFFAOYSA-N
Exact Mass
236.07200
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The molecular formula is C12H13ClN2O.
What is the molecular weight of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The molecular weight is 236.70 g/mol.
When was 2-Chloro-4-(3-piperidinyloxy)benzonitrile created in PubChem?
It was created on February 29, 2008.
What is the IUPAC name of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The IUPAC name is 2-chloro-4-piperidin-3-yloxybenzonitrile.
What is the InChI of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The InChI is InChI=1S/C12H13ClN2O/c13-12-6-10(4-3-9(12)7-14)16-11-2-1-5-15-8-11/h3-4,6,11,15H,1-2,5,8H2.
What is the Canonical SMILES of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The Canonical SMILES is C1CC(CNC1)OC2=CC(=C(C=C2)C#N)Cl.
How many hydrogen bond donor counts does 2-Chloro-4-(3-piperidinyloxy)benzonitrile have?
It has 1 hydrogen bond donor count.
What is the XLogP3-AA value of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The XLogP3-AA value is 2.4.
What is the topological polar surface area of 2-Chloro-4-(3-piperidinyloxy)benzonitrile?
The topological polar surface area is 45 2.
Is 2-Chloro-4-(3-piperidinyloxy)benzonitrile a canonicalized compound in PubChem?
Yes, it is a canonicalized compound in PubChem.
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