ChemicalBook--->CAS DataBase List--->54239-37-1

54239-37-1

54239-37-1 Structure

54239-37-1 Structure
IdentificationBack Directory
[Name]

CIMATEROL
[CAS]

54239-37-1
[Synonyms]

CiMater
CIMATEROL
CIMETEROL
CL-263780
cimaterol Solution, 100ppm
2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile
2-AMINO-5-[1-HYDROXY-2-[(1-METHYLETHYL)AMINO]ETHYL]BENZONITRILE
Benzonitrile, 2-amino-5-[1-hydroxy-2-[(1-methylethyl)amino]ethyl]-
[Molecular Formula]

C12H17N3O
[MDL Number]

MFCD00209815
[MOL File]

54239-37-1.mol
[Molecular Weight]

219.28
Chemical PropertiesBack Directory
[Melting point ]

162-164?C
[Boiling point ]

436.6±45.0 °C(Predicted)
[density ]

1.14±0.1 g/cm3(Predicted)
[RTECS ]

DI2457930
[storage temp. ]

Store at RT
[solubility ]

Soluble in ethanol or DMSO
[form ]

neat
[pka]

13.75±0.20(Predicted)
[color ]

White to Off-White
[BRN ]

2418129
[Major Application]

clinical testing
[InChI]

1S/C12H17N3O/c1-8(2)15-7-12(16)9-3-4-11(14)10(5-9)6-13/h3-5,8,12,15-16H,7,14H2,1-2H3
[InChIKey]

BUXRLJCGHZZYNE-UHFFFAOYSA-N
[SMILES]

CC(C)NCC(O)c1ccc(N)c(c1)C#N
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-36-43
[Safety Statements ]

26-36/37
[WGK Germany ]

3
[HS Code ]

29269090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Sens. 1
Hazard InformationBack Directory
[Chemical Properties]

Off-White Solid
[Uses]

A beta-adrenergic agonist
[Uses]

A β-adrenergic agonist, related to Clenbuterol and Mabuterol. A repartitioning agent.
[Uses]

antiasthmatic
[Definition]

ChEBI: 2-amino-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzonitrile is a member of benzenes and a nitrile.
[Biological Activity]

β -Adrenergic agonist.
[storage]

Store at RT
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