CAS
972-17-8 Purity
96%
972-17-8 Purity
96%
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1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile
CAS
972-19-0
Catalog Number
ACM972190
Category
Other Products
Molecular Weight
305.416720 [g/mol]
Molecular Formula
C20H23N3
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Specification
Synonyms
Ambsda500035749, MLS002693818, NSC73010, MolPort-003-909-748, CID70417, EINECS 213-544-0, SMR001559759, 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile, 972-19-0
IUPAC Name
1-benzyl-4-(4-methylanilino)piperidine-4-carbonitrile
InChI Key
OIDUIUJRLUPBPH-UHFFFAOYSA-N
Boiling Point
479.6ºC at 760mmHg
Flash Point
243.9ºC
Density
1.13g/cm³
Exact Mass
305.18900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The molecular formula is C20H23N3.
What is the molecular weight of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The molecular weight is 305.4 g/mol.
What is the IUPAC name of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The IUPAC name is 1-benzyl-4-(4-methylanilino)piperidine-4-carbonitrile.
What is the InChI of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The InChI is InChI=1S/C20H23N3/c1-17-7-9-19(10-8-17)22-20(16-21)11-13-23(14-12-20)15-18-5-3-2-4-6-18/h2-10,22H,11-15H2,1H3.
What is the InChIKey of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The InChIKey is OIDUIUJRLUPBPH-UHFFFAOYSA-N.
What is the canonical SMILES of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The canonical SMILES is CC1=CC=C(C=C1)NC2(CCN(CC2)CC3=CC=CC=C3)C#N.
What is the CAS number of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The CAS number is 972-19-0.
What is the European Community (EC) Number of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The European Community (EC) Number is 213-544-0.
What is the ChEMBL ID of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The ChEMBL ID is CHEMBL1906614.
What is the XLogP3-AA value of 1-Benzyl-4-(p-toluidino)piperidine-4-carbonitrile?
The XLogP3-AA value is 3.9.
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