Cimbuterol

Basic Info

FADB-China IDC0201
Substance NameBeta stimulants
Substance Chinese NameΒ-兴奋剂类药物
Molecular NameCimbuterol
Molecular Chinese Name西布特罗
2D StructureNo image
CAS Number54239-39-3
PubChem CID3027547
FormulaC13H19N3O
IUPAC Name2-amino-5-[2-(tert-butylamino)-1-hydroxyethyl]benzonitrile
InChI KeyYKKQAXQGZIBJFS-UHFFFAOYSA-N
InChIInChI=1S/C13H19N3O/c1-13(2,3)16-8-12(17)9-4-5-11(15)10(6-9)7-14/h4-6,12,16-17H,8,15H2,1-3H3
Canonical SMILES

CC(C)(C)NCC(C1=CC(=C(C=C1)N)C#N)O

Isomeric SMILES

CC(C)(C)NCC(C1=CC(=C(C=C1)N)C#N)O

CFM-ID 3.0URL Link
Related linksPlanting/breeding
Addition PurposesIncrease lean meat percentage
Molecular Synonyms
        
            Cimbuterol
        
            54239-39-3
        
            2-amino-5-[2-(tert-butylamino)-1-hydroxyethyl]benzonitrile
        
            AC1MHJTB
        
            SCHEMBL9706066
        
            DTXSID30388626
        
            FT-0665041
        
            Cimbuterol, VETRANAL(TM), analytical standard
        
            2-Amino-5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]benzonitrile
        
            2-Amino-5-(2-tert-butylamino-1-hydroxyethyl)benzonitrile
Data UploaderMinQing Cai
Update DateAug 02, 2019 13:24

Properties

Property NameProperty Value
Molecular Weight233.31
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Complexity289
Monoisotopic Mass233.15281225
Exact Mass233.15281225
XLogP1.2
Formal Charge0
Heavy Atom Count17
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Isotope Atom Count0
Covalently-Bonded Unit Count1

Related Foods

FADB-China ID F0070
Food Image No Pictures
Food Name Pork, red meat and liver
Food Chinese Name 猪肉、牛羊肉及肝脏
Food Type Non-processed food
References List of non-edible substances that may be illegally added in food (fourth batch)

Potential Illegal Additives

ID Structure Name Source PubChem Link


No Image

Cimaterol		 

National Health Commission of the People's Republic of China, OpenFoodTox, ToxCast & Tox21 Chemicals

Link

References

TitleDOI/PubMed/ISSN
List of non-edible substances that may be illegally added in food (fourth batch)