CAS
94201-35-1 Purity
96%
94201-35-1 Purity
96%
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1-Phenylpiperidine-4-carboxylic acid
CAS
94201-40-8
Catalog Number
ACM94201408
Category
Other Products
Molecular Weight
205.253
Molecular Formula
C12H15NO2
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Specification
Synonyms
1-phenylpiperidine-4-carboxylic acid;1-Phenyl-4-piperidinecarboxylic acid
IUPAC Name
1-phenylpiperidine-4-carboxylic acid
Canonical SMILES
C1CN(CCC1C(=O)O)C2=CC=CC=C2
InChI Key
IXLCEJNZWAYHPL-UHFFFAOYSA-N
Boiling Point
379.6ºC at 760mmHg
Flash Point
183.4ºC
Density
1.179g/cm³
EC Number
303-626-5
Exact Mass
205.11000
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 1-Phenylpiperidine-4-carboxylic acid?
The molecular formula of 1-Phenylpiperidine-4-carboxylic acid is C12H15NO2.
When was 1-Phenylpiperidine-4-carboxylic acid created and last modified according to PubChem?
1-Phenylpiperidine-4-carboxylic acid was created on 2005-08-08 and last modified on 2023-12-30.
What is the IUPAC Name of 1-Phenylpiperidine-4-carboxylic acid?
The IUPAC Name of 1-Phenylpiperidine-4-carboxylic acid is 1-phenylpiperidine-4-carboxylic acid.
What is the InChIKey of 1-Phenylpiperidine-4-carboxylic acid?
The InChIKey of 1-Phenylpiperidine-4-carboxylic acid is IXLCEJNZWAYHPL-UHFFFAOYSA-N.
What is the Canonical SMILES of 1-Phenylpiperidine-4-carboxylic acid?
The Canonical SMILES of 1-Phenylpiperidine-4-carboxylic acid is C1CN(CCC1C(=O)O)C2=CC=CC=C2.
What is the molecular weight of 1-Phenylpiperidine-4-carboxylic acid?
The molecular weight of 1-Phenylpiperidine-4-carboxylic acid is 205.25 g/mol.
How many hydrogen bond donor counts does 1-Phenylpiperidine-4-carboxylic acid have?
1-Phenylpiperidine-4-carboxylic acid has 1 hydrogen bond donor count.
What is the topological polar surface area of 1-Phenylpiperidine-4-carboxylic acid?
The topological polar surface area of 1-Phenylpiperidine-4-carboxylic acid is 40.5 Å2.
How many heavy atoms are present in the structure of 1-Phenylpiperidine-4-carboxylic acid?
There are 15 heavy atoms present in the structure of 1-Phenylpiperidine-4-carboxylic acid.
Is the compound canonicalized according to PubChem?
Yes, the compound is canonicalized according to PubChem.
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