Arotinolol

Arotinolol

Arotinolol

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Keywords

2-(3-tert-Butylamino-2-hydroxypropylthio)-4-(5-carbamoyl-2-thienyl)thiazole NSC 317940 Arotinolol

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  • Application:Molecular structure of Arotinolol (CAS NO.68377-92-4) is: Product Name: Arotinolol CAS Registry Number: 68377-92-4 IUPAC Name: 5-[2-[3-(Tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl
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  • Transportation:Molecular structure of Arotinolol (CAS NO.68377-92-4) is: Product Name: Arotinolol CAS Registry Number: 68377-92-4 IUPAC Name: 5-[2-[3-(Tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl

Superiority:

Molecular structure of Arotinolol (CAS NO.68377-92-4) is:

Product Name: Arotinolol 
CAS Registry Number: 68377-92-4
IUPAC Name: 5-[2-[3-(Tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl]thiophene-2-carboxamide 
Molecular Weight: 371.54114 [g/mol]   
Molecular Formula: C15H21N3O2S3   
XLogP3-AA: 2.3   
H-Bond Donor: 3   
H-Bond Acceptor: 4 
Index of Refraction: 1.646  
Molar Refractivity: 99.5 cm3  
Molar Volume: 274 cm3 
Surface Tension: 67.8 dyne/cm  
Density: 1.35 g/cm3  
Flash Point: 316.6 °C  
Enthalpy of Vaporization: 93.9 kJ/mol  
Boiling Point: 599.8 °C at 760 mmHg  
Vapour Pressure: 3.09E-15 mmHg at 25 °C  
Other Registry Number: 52560-77-7 
Classification Code: Adrenergic alpha-Antagonists ; Adrenergic beta-Antagonists 
Canonical SMILES: CC(C)(C)NCC(CSC1=NC(=CS1)C2=CC=C(S2)C(=O)N)O
InChI: InChI=1S/C15H21N3O2S3/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20)  
InChIKey: BHIAIPWSVYSKJS-UHFFFAOYSA-N

Details:

Molecular structure of Arotinolol (CAS NO.68377-92-4) is:

Product Name: Arotinolol 
CAS Registry Number: 68377-92-4
IUPAC Name: 5-[2-[3-(Tert-butylamino)-2-hydroxypropyl]sulfanyl-1,3-thiazol-4-yl]thiophene-2-carboxamide 
Molecular Weight: 371.54114 [g/mol]   
Molecular Formula: C15H21N3O2S3   
XLogP3-AA: 2.3   
H-Bond Donor: 3   
H-Bond Acceptor: 4 
Index of Refraction: 1.646  
Molar Refractivity: 99.5 cm3  
Molar Volume: 274 cm3 
Surface Tension: 67.8 dyne/cm  
Density: 1.35 g/cm3  
Flash Point: 316.6 °C  
Enthalpy of Vaporization: 93.9 kJ/mol  
Boiling Point: 599.8 °C at 760 mmHg  
Vapour Pressure: 3.09E-15 mmHg at 25 °C  
Other Registry Number: 52560-77-7 
Classification Code: Adrenergic alpha-Antagonists ; Adrenergic beta-Antagonists 
Canonical SMILES: CC(C)(C)NCC(CSC1=NC(=CS1)C2=CC=C(S2)C(=O)N)O
InChI: InChI=1S/C15H21N3O2S3/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20)  
InChIKey: BHIAIPWSVYSKJS-UHFFFAOYSA-N

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