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(1S,3S,5S)-3-(Aminocarbonyl)-2-azabicyclo[3.1.0]hexane-2-carboxylic acid tert-butyl ester / Saxagliptin intermediate 361440-67-7

(1S,3S,5S)-3-(Aminocarbonyl)-2-azabicyclo[3.1.0]hexane-2-carboxylic acid tert-butyl ester / Saxagliptin intermediate 361440-67-7

99% up by HPLC
  • Product Details

Product Information


Product name

(1S,3S,5S)-3-(Aminocarbonyl)-2-azabicyclo[3.1.0]hexane-2-carboxylic acid tert-butyl ester / Saxagliptin intermediate

CAS No.

361440-67-7

Molecular Formula

C11H18N2O3

Molecular Weight

226.276

Quality Standard

98% up by HPLC

Appearance

White to off-white powder


COA of (1S,3S,5S)-3-(Aminocarbonyl)-2-azabicyclo[3.1.0]hexane-2-carboxylic acid tert-butyl ester


ITEMS

SPECIFICATION

RESULT

Appearance

White to off-white powder

Conforms

Identification by HPLC

The retention time of sample major peak complies to reference standard

Conforms

Related impurity

2.0%

1.30%

Loss on drying

1.0%

0.3%

PurityHPLC

98.0%

98.70%

Conclusion

The sample confirm to the In-house standard


Usage


(1S,3S,5S)-3-(Aminocarbonyl)-2-azabicyclo[3.1.0]hexane-2-carboxylic acid tert-butyl ester  is one of key Intermediate of Saxagliptin.


Physical properties about (1S,3S,5S)-3-(Aminocarbonyl)-2-azabicyclo[3.1.0]hexane-2-carboxylic acid tert-butyl ester are: 

(1)ACD/LogP: -0.534;

(2)ACD/LogD (pH 5.5): -0.53;

(3)ACD/LogD (pH 7.4): -0.53;

(4)ACD/BCF (pH 5.5): 1.00;

(5)ACD/BCF (pH 7.4): 1.00;

(6)ACD/KOC (pH 5.5): 12.20;

(7)ACD/KOC (pH 7.4): 12.20;

(8)#H bond acceptors: 5;

(9)#H bond donors: 2;

(10)#Freely Rotating Bonds: 3;

(11)Index of Refraction: 1.538;

(12)Molar Refractivity: 57.6 cm3;

(13)Molar Volume: 184.139 cm3;

(14)Polarizability: 22.834 10-24cm3;

(15)Surface Tension: 49.5180015563965 dyne/cm;

(16)Density: 1.229 g/cm3;

(17)Flash Point: 189.024 °C;

(18) Enthalpy of Vaporization: 63.821 kJ/mol;

(19)Boiling Point: 388.94 °C at 760 mmHg

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