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Name |
Rubiflavin |
EINECS | N/A |
CAS No. | 11016-71-0 | Density | 1.37g/cm3 |
PSA | N/A | LogP | N/A |
Solubility | N/A | Melting Point |
N/A |
Formula | N/A | Boiling Point | 882.4°C at 760 mmHg |
Molecular Weight | 730.8431 | Flash Point | 487.5°C |
Transport Information | N/A | Appearance | N/A |
Safety | Poison by subcutaneous and intraperitoneal routes. Mutation data reported. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | 3 | |
Synonyms |
Rubiflavin |
Rubiflavin with CAS register number of 11016-71-0 is also named as NSC 105023 ; CID6450217 ; LS-143962 ; B 17476 ,and so on.
IUPAC Name: 10-[(2R,4S,5S,6S)-4-(Dimethylamino)-5-hydroxy-4,6-dimethyloxan-2-yl]-8-[(2R,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-11-hydroxy-5-methyl-2-[2-methyl-3-[(Z)-prop-1-enyl]oxiran-2-yl]naphtho[3,2-h]chromene-4,7,12-trione
CAS: 11016-71-0
Molecualr Formula: C41H50N2O10
Molecular Weight: 730.8431
Molecular structure:
ACD/LogD (pH 5.5): 1.9
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 5.5): 2.03
ACD/BCF (pH 7.4): 29
ACD/KOC (pH 5.5): 4.83
ACD/KOC (pH 7.4): 69.02
H bond acceptors: 12
H bond donors: 3
Freely Rotating Bonds: 9
Index of Refraction: 1.652
Molar Refractivity: 194.59 cm3
Molar Volume: 532.1 cm3
Polarizability: 77.14×10-24cm3
Surface Tension: 67.5 dyne/cm
Density: 1.37 g/cm3
Flash Point: 487.5 °C
Enthalpy of Vaporization: 134.37 kJ/mol
Boiling Point: 882.4 °C at 760 mmHg
Vapour Pressure: 2.32E-33 mmHg at 25°C
Rubiflavin (CAS No.11016-71-0) is supposed to be used as chemical reagent.
1. | dnd-esc 10 mg/L | MUREAV Mutation Research. 89 (1981),95. | ||
2. | pic-esc 1 ng/plate | CNREA8 Cancer Research. 43 (1983),2819. | ||
3. | ipr-mus LD50:15 mg/kg | 85ERAY Antibiotics: Origin, Nature, and Properties. 2 (1978),1438. | ||
4. | scu-mus LD50:14,310 µg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . |
Rubiflavin (CAS No.11016-71-0) is poisonous by subcutaneous and intraperitoneal routes. Mutation data reported.
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