N-(3',6'-Dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)dodecanamide supplier

Name
5-Dodecanoylaminofluorescein
EINECS
CAS No. 107827-77-0
Density 1.309 g/cm³
Solubility
Melting Point
Formula C₃₂H₃₅NO₆
Boiling Point 773.655 °C at 760 mmHg
Molecular Weight 529.633
Flash Point 421.692 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Spiro[isobenzofuran-1(3H),9'-[9H]xanthene],dodecanamide deriv.;5-(N-Dodecanoylamino)fluorescein;5-Dodecanoylaminofluorescein;
PSA 108.58000
LogP 8.17470

N-(3',6'-Dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)dodecanamide Specification

The Dodecanamide,N-(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)-, with the CAS registry number 107827-77-0, is also known as N-(3',6'-Dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-5-yl)dodecanamide. This chemical's molecular formula is C₃₂H₃₅NO₆ and molecular weight is 529.25. What's more, its IUPAC name is called N-(3',6'-Dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)dodecanamide.

Physical properties about Dodecanamide,N-(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)- are: (1)ACD/LogP: 7.084; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 7.08; (4)ACD/LogD (pH 7.4): 7.08; (5)ACD/BCF (pH 5.5): 142604.10; (6)ACD/BCF (pH 7.4): 141056.20; (7)ACD/KOC (pH 5.5): 170171.90; (8)ACD/KOC (pH 7.4): 168324.80; (9)#H bond acceptors: 7; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 105.09 Å²; (13)Index of Refraction: 1.649; (14)Molar Refractivity: 147.329 cm³; (15)Molar Volume: 404.618 cm³; (16) Polarizability: 58.406×10^-24cm³; (17)Surface Tension: 65.746 dyne/cm; (18)Density: 1.309 g/cm³; (19)Flash Point: 421.692 °C; (20)Enthalpy of Vaporization: 116.555 kJ/mol; (21)Boiling Point: 773.655 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Nc1cc2c(cc1)C4(OC2=O)c5ccc(O)cc5Oc3cc(O)ccc34)CCCCCCCCCCC
(2) InChI: InChI=1S/C32H35NO6/c1-2-3-4-5-6-7-8-9-10-11-30(36)33-21-12-15-25-24(18-21)31(37)39-32(25)26-16-13-22(34)19-28(26)38-29-20-23(35)14-17-27(29)32/h12-20,34-35H,2-11H2,1H3,(H,33,36)
(3) InChIKey: VJNRUQFWKRLMSL-UHFFFAOYSA-N

Product Name

5-Dodecanoylaminofluorescein

N-(3',6'-Dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)dodecanamide Specification

Related Products

Hot Products