CAS
955315-21-6 Purity
96%
955315-21-6 Purity
96%
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2-(4-Methoxy-3,5-dimethyl-benzyl)-piperidine
CAS
955315-30-7
Catalog Number
ACM955315307
Category
Other Products
Molecular Weight
233.35
Molecular Formula
C15H23NO
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Specification
Synonyms
2-(4-Methoxy-3,5-dimethyl-benzyl)-piperidine, 955315-30-7, AGN-PC-01A9DL, CTK5H7829, AB49930, AG-H-93012, 2-[(4-methoxy-3,5-dimethylphenyl)methyl]piperidine
IUPAC Name
2-[(4-methoxy-3,5-dimethylphenyl)methyl]piperidine
Canonical SMILES
CC1=CC(=CC(=C1OC)C)CC2CCCCN2
InChI Key
BXCSCSJHYFFWMR-UHFFFAOYSA-N
Boiling Point
335ºC at 760 mmHg
Flash Point
142.3ºC
Density
0.983g/cm³
Exact Mass
233.17800
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of the compound?
The molecular formula of the compound is C15H23NO.
What is the molecular weight of the compound?
The molecular weight of the compound is 233.35 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 2-[(4-methoxy-3,5-dimethylphenyl)methyl]piperidine.
What is the InChIKey of the compound?
The InChIKey of the compound is BXCSCSJHYFFWMR-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is CC1=CC(=CC(=C1OC)C)CC2CCCCN2.
What is the CAS number of the compound?
The CAS number of the compound is 955315-30-7.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 3.4.
How many hydrogen bond donor counts are there in the compound?
There is 1 hydrogen bond donor count in the compound.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 21.3 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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