Chemical Properties of Riboflavin, 2',3',4',5'-tetraacetate (CAS 752-13-6)

Riboflavin, 2',3',4',5'-tetraacetate

InChI
InChI=1S/C25H28N4O10/c1-11-7-17-18(8-12(11)2)29(23-21(26-17)24(34)28-25(35)27-23)9-19(37-14(4)31)22(39-16(6)33)20(38-15(5)32)10-36-13(3)30/h7-8,19-20,22H,9-10H2,1-6H3,(H,28,34,35)
InChI Key
VKVDYPHLGLIXAG-UHFFFAOYSA-N
Formula
C25H28N4O10
SMILES
CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(Cn1c2nc(=O)[nH]c(=O)c-2nc2cc(C)c(C)cc21)OC(C)=O
Molecular Weight1
544.51
CAS
752-13-6
Other Names
  • Riboflavin tetraacetate
  • Riboflavine tetraacetate
  • Riboflavine, 2',3',4',5'-tetraacetate
  • Tetra-O-acetylriboflavine
  • Tetraacetylriboflavin
  • Tetraacetylriboflavine
  • Vitamin B2 tetraacetate
  • 2',3',4',5'-Tetra-O-acetylriboflavin
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Physical Properties

Property Value Unit Source
ω 1.2446 Relay (1.0) Calculated Property
ΔfG° -680.53 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -1604.33 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 183.12 kJ/mol Relay (1.0) Calculated Property
IE 8.14 eV Relay (1.0) Calculated Property
log10WS -3.73 Relay (1.0) Calculated Property
logPoct/wat 0.078 Crippen Calculated Property
McVol 381.850 ml/mol McGowan Calculated Property
Pc 887.55 kPa Relay (1.0-beta) Calculated Property
Tboil 803.44 K Relay (1.0) Calculated Property
Tc 1121.05 K Relay (1.0) Calculated Property
Tfus 472.75 K Relay (1.0) Calculated Property
Vc 1.395 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Riboflavin, 2',3',4',5'-tetrabutanoate. inosine-5'-monophosphate, TMS. xanthosine-5'-monophosphate, TMS. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Quinine, trimethylsilyl ether. Riboflavin, 2',3',4',5'-tetrapropanoate. Mephenesin, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine. Ergocristine.

Find more compounds similar to Riboflavin, 2',3',4',5'-tetraacetate.

Sources

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