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Tulobuterol

CAT: 0572-TRC-T897250-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T897250-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
41570-61-0
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
CC(C)(C)NCC(O)c1ccccc1Cl
Molecular Formula
C12 H18 Cl N O
Molecular Weight
227.73
InChI
InChI=1S/C12H18ClNO/c1-12(2,3)14-8-11(15)9-6-4-5-7-10(9)13/h4-7,11,14-15H,8H2,1-3H3
Additionnal Information
IUPAC name: 2-(tert-butylamino)-1-(2-chlorophenyl)ethanol
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Tulobuterol

2-(tert-butylamino)-1-(2-chlorophenyl)ethanol is an organochlorine compound.

CAS Number41570-61-0
PubChem CID5606
IUPAC Name2-(tert-butylamino)-1-(2-chlorophenyl)ethanol
Molecular FormulaC12H18ClNO
Molecular Weight227.73
XLogP2.3
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity191
SMILES
CC(C)(C)NCC(C1=CC=CC=C1Cl)O
InChI
InChI=1S/C12H18ClNO/c1-12(2,3)14-8-11(15)9-6-4-5-7-10(9)13/h4-7,11,14-15H,8H2,1-3H3
InChIKey
YREYLAVBNPACJM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tulobuterol
CAS: 41570-61-0
CID: 5606
Formula: C12H18ClNO
MW: 227.73
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight227.73
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass227.1076919
Monoisotopic Mass227.1076919
Topological Polar Surface Area32.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity191
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA5120-100Tulobuterol
MBS3605064-01Tulobuterol hydrochloride
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