GUAIACOL NICOTINATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H11NO3
Molecular Weight	229.2313
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of GUAIACOL NICOTINATE

Structure Search

SMILES

COC1=CC=CC=C1OC(=O)C2=CC=CN=C2

InChI

InChIKey=KVPUDAXRVGUATI-UHFFFAOYSA-N

InChI=1S/C13H11NO3/c1-16-11-6-2-3-7-12(11)17-13(15)10-5-4-8-14-9-10/h2-9H,1H3

HIDE SMILES / InChI

Molecular Formula	C13H11NO3
Molecular Weight	229.2313
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 `Mon Mar 31 17:54:21 GMT 2025` Edited by `admin` on `Mon Mar 31 17:54:21 GMT 2025`
Record UNII	0NL78157RR
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GUAIACOL NICOTINATE

Preferred Name

English

Code System Code Type Description

FDA UNII

0NL78157RR

Created by admin on Mon Mar 31 17:54:21 GMT 2025 , Edited by admin on Mon Mar 31 17:54:21 GMT 2025

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PUBCHEM

84772

Created by admin on Mon Mar 31 17:54:21 GMT 2025 , Edited by admin on Mon Mar 31 17:54:21 GMT 2025

PRIMARY

CAS

15057-98-4

Created by admin on Mon Mar 31 17:54:21 GMT 2025 , Edited by admin on Mon Mar 31 17:54:21 GMT 2025

PRIMARY

ECHA (EC/EINECS)

239-123-1

Created by admin on Mon Mar 31 17:54:21 GMT 2025 , Edited by admin on Mon Mar 31 17:54:21 GMT 2025

PRIMARY

EPA CompTox

DTXSID00164575

Created by admin on Mon Mar 31 17:54:21 GMT 2025 , Edited by admin on Mon Mar 31 17:54:21 GMT 2025

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