Basic information
- Name:
1-Propanone,1-[4-[[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)-
- Superlist Name:
- Neosperidin dihydrochalcone
- CAS No.:
20702-77-6
- Molecular Structure:
![Molecular Structure of 20702-77-6 (1-Propanone,1-[4-[[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)-)](http://www.lookchem.com/300w/2010/0619/20702-77-6.jpg)
- Formula:
- C28H36O15
- Molecular Weight:
- 612.58
- Synonyms:
- 1-(4-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)-;3,5-Dihydroxy-4-(3-hydroxy-4-methoxyhydrocinnamoyl)phenyl) 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside;CCRIS 4848;Glucopyranoside, 3,5-dihydroxy-4-(3-hydroxy-4-methoxyhydrocinnamoyl)phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-, beta-D-;NCI-C60764;Neohesperidin dhc;Nhdc;
- EINECS:
- 243-978-6
- Density:
- 1.61 g/cm3
- Melting Point:
- 156-158 °C
- Boiling Point:
- 927.1 °C at 760 mmHg
- Flash Point:
- 302.6 °C
- Solubility:
- Insoluble in water
- Appearance:
- Off-white crystals or powder
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Chemistry
IUPAC Name: 1-[4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)propan-1-one
Synonyms of 1-Propanone,1-[4-[[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)- (CAS NO.20702-77-6): 1-(4-((2-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(3-hydroxy-4-methoxyphenyl)- ; 1-Propanone, 1-(4-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)2,6-dihydroxyphenyl)-3-(3-hydroxy-4-me ; 3,5-Dihydroxy-4-(3-hydroxy-4-methoxyhydrocinnamoyl)phenyl) 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside ; CCRIS 4848 ; EINECS 243-978-6 ; Glucopyranoside, 3,5-dihydroxy-4-(3-hydroxy-4-methoxyhydrocinnamoyl)phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-, beta-D- ; NCI-C60764 ; Neohesperidin dc ; Neohesperidin dhc ; Neohesperidin dihydrochalcone ; Nhdc
CAS NO: 20702-77-6
Classification Code: Mutation data
Molecular Formula of 1-Propanone,1-[4-[[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)- (CAS NO.20702-77-6): C28H36O15
Molecular Weight: 612.5764
Molecular Structure:
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Melting Point: 156-158 °C
H bond acceptors: 15
H bond donors: 9
Freely Rotating Bonds: 19
Polar Surface Area: 146.29 Å2
Index of Refraction: 1.684
Molar Refractivity: 143.85 cm3
Molar Volume: 378.7 cm3
Surface Tension: 97.5 dyne/cm
Density of 1-Propanone,1-[4-[[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)- (CAS NO.20702-77-6): 1.61 g/cm3
Flash Point: 302.6 °C
Enthalpy of Vaporization: 141.27 kJ/mol
Boiling Point: 927.1 °C at 760 mmHg
Uses
1-Propanone,1-[4-[[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(3-hydroxy-4-methoxyphenyl)- (CAS NO.20702-77-6) is used as high sweetness of non-nutritive sweeteners and flavor enhancer.
Safety Profile
WGK Germany: 3
RTECS: LZ5785000
