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n-Propyl beta-lactoside

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Name

n-Propyl beta-lactoside

EINECS N/A
CAS No. 98302-29-5 Density 1.53 g/cm3
PSA 178.53000 LogP -3.96290
Solubility N/A Melting Point N/A
Formula C15H28O11 Boiling Point 652.1 °C at 760 mmHg
Molecular Weight 384.381 Flash Point 348.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 98302-29-5 (BETA-D-GAL-[1->4]-BETA-D-GLC-1->OPR) Hazard Symbols N/A
Synonyms

n-Propyl beta-lactoside;

Article Data 3

n-Propyl beta-lactoside Specification

The cas register number of n-Propyl beta-lactoside is 98302-29-5. It also can be called as Lactoside, propyl (7CI) and the Systematic name about this chemical is propyl 4-O-hexopyranosylhexopyranoside.

Physical properties about n-Propyl beta-lactoside are: (1)ACD/LogP: -2.10; (2)# of Rule of 5 Violations: 2; (3)#H bond acceptors: 11; (4)#H bond donors: 7; (5)#Freely Rotating Bonds: 14; (6)Polar Surface Area: 101.53Å2; (7)Index of Refraction: 1.591; (8)Molar Refractivity: 84.9 cm3; (9)Molar Volume: 250.9 cm3; (10)Polarizability: 33.65x10-24cm3; (11)Surface Tension: 80.6 dyne/cm; (12)Enthalpy of Vaporization: 110.03 kJ/mol; (13)Vapour Pressure: 9.11E-20 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(CCC)C2OC(C(OC1OC(CO)C(O)C(O)C1O)C(O)C2O)CO
(2)InChI: InChI=1/C15H28O11/c1-2-3-23-14-12(22)10(20)13(7(5-17)25-14)26-15-11(21)9(19)8(18)6(4-16)24-15/h6-22H,2-5H2,1H3
(3)InChIKey: HZJDMJJGLSPWNV-UHFFFAOYAH

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