U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula 2C6H4NO2.Fe
Molecular Weight 300.048
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FERROUS NICOTINATE

SMILES

[Fe++].[O-]C(=O)C1=CC=CN=C1.[O-]C(=O)C2=CC=CN=C2

InChI

InChIKey=SLSOHEBQPQLNCI-UHFFFAOYSA-L
InChI=1S/2C6H5NO2.Fe/c2*8-6(9)5-2-1-3-7-4-5;/h2*1-4H,(H,8,9);/q;;+2/p-2

HIDE SMILES / InChI
Molecular Formula C6H4NO2
Molecular Weight 122.1015
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula Fe
Molecular Weight 55.845
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:25:40 UTC 2023
Edited
by admin
on Sat Dec 16 01:25:40 UTC 2023
Record UNII
2X09DF94BO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FERROUS NICOTINATE
WHO-DD  
Common Name English
IRON DINICOTINATE
Systematic Name English
NICOTINIC ACID, IRON(2+) SALT
Common Name English
Ferrous nicotinate [WHO-DD]
Common Name English
Code System Code Type Description
SMS_ID
100000086968
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
PUBCHEM
82583
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
EVMPD
SUB02174MIG
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID40145944
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
ECHA (EC/EINECS)
233-785-5
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
FDA UNII
2X09DF94BO
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
CAS
10361-13-4
Created by admin on Sat Dec 16 01:25:40 UTC 2023 , Edited by admin on Sat Dec 16 01:25:40 UTC 2023
PRIMARY
Related Record Type Details
Structure of NIACIN
PARENT -> SALT/SOLVATE
Structure of FERROUS CATION
PARENT -> SALT/SOLVATE
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966