CAS No.27687-14-5,BOC-TRANEXAMIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	27687-14-5
Name:	BOC-TRANEXAMIC ACID
Article Data:	20

Formula:	C₁₃H₂₃NO₄
Molecular Weight:	257.33
Synonyms:	Cyclohexanecarboxylicacid, 4-[(carboxyamino)methyl]-, N-tert-butyl ester, trans- (8CI);BOC-Tranexamic acid;trans-1-[((tert-Butyloxycarbonyl)amino)methyl]cyclohexane-4-carboxylic acid;trans-4-(tert-Butoxycarbonylaminomethyl)cyclohexanecarboxylic acid;trans-4-tert-Butoxycarbonylaminomethylcyclohexylcarboxylic acid;
Density:	1.096 g/cm³
Melting Point:	133.0 to 137.0 °C
Boiling Point:	410 °C at 760 mmHg
Flash Point:	201.8 °C
PSA:	75.63000
LogP:	2.79300

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Specification

The CAS register number of Boc-tranexamic acid is 27687-14-5. It also can be called as trans-4-(tert-Butoxycarbonylaminomethyl)cyclohexanecarboxylic acid and the systematic name about this chemical is 4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylic acid. The molecular formula about this chemical is C₁₃H₂₃NO₄and molecular weight is 257.33. It belongs to the Amino Acids.

Physical properties about Boc-tranexamic acid are: (1)ACD/LogP: 2.10; (2)ACD/LogD (pH 5.5): 1.45; (3)ACD/LogD (pH 7.4): ; (4)ACD/BCF (pH 5.5): 5.2; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 74.21; (7)ACD/KOC (pH 7.4): 1.26; (8)#H bond acceptors: 5; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 55.84Å²; (12)Index of Refraction: 1.482; (13)Molar Refractivity: 66.97 cm³; (14)Molar Volume: 234.6 cm³; (15)Polarizability: 26.54x10^-24cm³; (16)Surface Tension: 39.7 dyne/cm; (17)Enthalpy of Vaporization: 72.66 kJ/mol; (18)Boiling Point: 410 °C at 760 mmHg; (19)Vapour Pressure: 7.17E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)NCC1CCC(C(=O)O)CC1
(2)InChI: InChI=1/C13H23NO4/c1-13(2,3)18-12(17)14-8-9-4-6-10(7-5-9)11(15)16/h9-10H,4-8H2,1-3H3,(H,14,17)(H,15,16)
(3)InChIKey: AZEKNJGFCSHZID-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C13H23NO4/c1-13(2,3)18-12(17)14-8-9-4-6-10(7-5-9)11(15)16/h9-10H,4-8H2,1-3H3,(H,14,17)(H,15,16)
(5)Std. InChIKey: AZEKNJGFCSHZID-UHFFFAOYSA-N