4-(3-Phenylpropyl)pyridine-2-carboxylic acid

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H15NO2
Molecular Weight	241.2851
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(3-Phenylpropyl)pyridine-2-carboxylic acid

Structure Search

SMILES

OC(=O)C1=NC=CC(CCCC2=CC=CC=C2)=C1

InChI

InChIKey=DWROTCRJYBGTDY-UHFFFAOYSA-N

InChI=1S/C15H15NO2/c17-15(18)14-11-13(9-10-16-14)8-4-7-12-5-2-1-3-6-12/h1-3,5-6,9-11H,4,7-8H2,(H,17,18)

HIDE SMILES / InChI

Molecular Formula	C15H15NO2
Molecular Weight	241.2851
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:56:34 GMT 2023` Edited by `admin` on `Sat Dec 16 11:56:34 GMT 2023`
Record UNII	2NAS7344W5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-(3-Phenylpropyl)pyridine-2-carboxylic acid

Systematic Name

English

4-(3-Phenylpropyl)-2-pyridinecarboxylic acid

Systematic Name

English

2-Pyridinecarboxylic acid, 4-(3-phenylpropyl)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

3019451

Created by admin on Sat Dec 16 11:56:34 GMT 2023 , Edited by admin on Sat Dec 16 11:56:34 GMT 2023

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FDA UNII

2NAS7344W5

Created by admin on Sat Dec 16 11:56:34 GMT 2023 , Edited by admin on Sat Dec 16 11:56:34 GMT 2023

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ECHA (EC/EINECS)

281-230-0

Created by admin on Sat Dec 16 11:56:34 GMT 2023 , Edited by admin on Sat Dec 16 11:56:34 GMT 2023

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EPA CompTox

DTXSID00232788

Created by admin on Sat Dec 16 11:56:34 GMT 2023 , Edited by admin on Sat Dec 16 11:56:34 GMT 2023

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CAS

83898-21-9

Created by admin on Sat Dec 16 11:56:34 GMT 2023 , Edited by admin on Sat Dec 16 11:56:34 GMT 2023

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