BUTYL ISONICOTINATE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H13NO2
Molecular Weight	179.2157
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BUTYL ISONICOTINATE

Structure Search

SMILES

CCCCOC(=O)C1=CC=NC=C1

InChI

InChIKey=UMQFMEMKBWWILL-UHFFFAOYSA-N

InChI=1S/C10H13NO2/c1-2-3-8-13-10(12)9-4-6-11-7-5-9/h4-7H,2-3,8H2,1H3

HIDE SMILES / InChI

Molecular Formula	C10H13NO2
Molecular Weight	179.2157
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 18:38:27 GMT 2023` Edited by `admin` on `Sat Dec 16 18:38:27 GMT 2023`
Record UNII	TVZ2PX9ZJ2
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BUTYL ISONICOTINATE

Systematic Name

English

4-PYRIDINECARBOXYLIC ACID N-BUTYL ESTER

Common Name

English

4-PYRIDINECARBOXYLIC ACID, BUTYL ESTER

Systematic Name

English

NSC-83155

Code

English

ISONICOTINIC ACID, BUTYL ESTER

Systematic Name

English

Code System Code Type Description

ECHA (EC/EINECS)

237-561-8

Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023

PRIMARY

NSC

83155

Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023

PRIMARY

PUBCHEM

83769

Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023

PRIMARY

FDA UNII

TVZ2PX9ZJ2

Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023

PRIMARY

EPA CompTox

DTXSID90160667

Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023

PRIMARY

CAS

13841-66-2

Created by admin on Sat Dec 16 18:38:27 GMT 2023 , Edited by admin on Sat Dec 16 18:38:27 GMT 2023

PRIMARY