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Details

Stereochemistry RACEMIC
Molecular Formula C16H31O2S.Bi.2HO
Molecular Weight 530.476
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BISMUTH BUTYLTHIOLAURATE

SMILES

[OH-].[OH-].[Bi+3].CCCCCCCCCCC(SCCCC)C([O-])=O

InChI

InChIKey=CWGPSMQADCZWKS-UHFFFAOYSA-K
InChI=1S/C16H32O2S.Bi.2H2O/c1-3-5-7-8-9-10-11-12-13-15(16(17)18)19-14-6-4-2;;;/h15H,3-14H2,1-2H3,(H,17,18);;2*1H2/q;+3;;/p-3

HIDE SMILES / InChI

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Bi
Molecular Weight 208.9804
Charge 3
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C16H31O2S
Molecular Weight 287.481
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:17:17 GMT 2023
Edited
by admin
on Sat Dec 16 02:17:17 GMT 2023
Record UNII
7184NNO64S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISMUTH BUTYLTHIOLAURATE
MI  
Systematic Name English
NEOCARDYL
Brand Name English
BISMUTH BUTYLTHIOLAURATE [MI]
Common Name English
BISMUTH, (2-(BUTYLTHIO)DODECANOATO-O,S)DIHYDROXY-, (T-4)-
Common Name English
DODECANOIC ACID, 2-(BUTYLTHIO)-, BISMUTH COMPLEX
Common Name English
BISSPECIA
Brand Name English
Code System Code Type Description
MERCK INDEX
m1032
Created by admin on Sat Dec 16 02:17:17 GMT 2023 , Edited by admin on Sat Dec 16 02:17:17 GMT 2023
PRIMARY Merck Index
CAS
53897-25-9
Created by admin on Sat Dec 16 02:17:17 GMT 2023 , Edited by admin on Sat Dec 16 02:17:17 GMT 2023
PRIMARY
PUBCHEM
86278197
Created by admin on Sat Dec 16 02:17:17 GMT 2023 , Edited by admin on Sat Dec 16 02:17:17 GMT 2023
PRIMARY
EPA CompTox
DTXSID00722194
Created by admin on Sat Dec 16 02:17:17 GMT 2023 , Edited by admin on Sat Dec 16 02:17:17 GMT 2023
PRIMARY
FDA UNII
7184NNO64S
Created by admin on Sat Dec 16 02:17:17 GMT 2023 , Edited by admin on Sat Dec 16 02:17:17 GMT 2023
PRIMARY