AG00DFBS

Name: Cimbuterol
Brand: Angene Chemical
SKU: AG00DFBS

54239-39-3 | Cimbuterol

AG00DFBS

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WARNING This product is not for human or veterinary use.

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CAS Number	54239-39-3
Catalog Number	AG00DFBS(AGN-PC-0KO2VQ)
Chemical Name	Cimbuterol
IUPAC Name	2-amino-5-[2-(tert-butylamino)-1-hydroxyethyl]benzonitrile
InChI	InChI=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
InChI Key	YKKQAXQGZIBJFS-UHFFFAOYSA-N
MDL Number	MFCD16652572
Molecular Formula	C13H19N3O
Molecular Weight	233.3095
SMILES	N#CC1=CC(C(CNC(C)(C)C)O)=CC=C1N
Synonyms	cimbuterol, 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-tert-butylamino-1-hydroxyethyl)benzonitrile, 2-Amino-5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]benzonitrile, CID3027547, 2-amino-5-[1-hydroxy-2-(tert-butylamino)ethyl]benzonitrile,

Complexity	289
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.153g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	233.315g/mol
Monoisotopic Mass	233.153g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	82.1A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited