CAS No.130194-92-2,10-Hydroxycamptothecin Suppliers

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Basic Information

Molecular Structure:
CAS No.:	130194-92-2
Name:	10-Hydroxycamptothecin
Article Data:	10

Formula:	C₂₀H₁₆N₂O₅
Molecular Weight:	364.357
Synonyms:	CAMPTOTHECIN, 10-HYDROXY-;CAMPTOTHECIN, 10-HYDROXY-, CAMPTOTHECA ACUMINATA;HCPT;HYDROXYCAMPTOTHECIN;HYDROXYCAMPTOTHECIN, 10-;SN38;1H-Pyrano3,4:6,7indolizino1,2-bquinoline-3,14(4H,12H)-dione, 4-ethyl-4,10-dihydroxy-
Density:	1.60
Boiling Point:	820.7oC at 760mmHg
Flash Point:	450.1oC
PSA:	101.65000
LogP:	1.78520

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Specification

The 1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione,4-ethyl-4,10-dihydroxy-, with CAS registry number 130194-92-2, has the systematic name of (4S)-4-ethyl-4,10-dihydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione. And the chemical formula of this chemical is C₂₀H₁₆N₂O₅.

Physical properties of 1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione,4-ethyl-4,10-dihydroxy-: (1)ACD/LogP: 0.97; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.92; (4)ACD/LogD (pH 7.4): 0.91; (5)ACD/BCF (pH 5.5): 2.86; (6)ACD/BCF (pH 7.4): 2.81; (7)ACD/KOC (pH 5.5): 71.56; (8)ACD/KOC (pH 7.4): 70.26; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 99.96 Å²; (13)Index of Refraction: 1.776; (14)Molar Refractivity: 94.97 cm³; (15)Molar Volume: 227 cm³; (16)Polarizability: 37.65×10^-24cm³; (17)Surface Tension: 92.4 dyne/cm; (18)Density: 1.6 g/cm³; (19)Flash Point: 450.1 °C; (20)Enthalpy of Vaporization: 125.05 kJ/mol; (21)Boiling Point: 820.7 °C at 760 mmHg; (22)Vapour Pressure: 1.67E-28 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC[C@]1(O)C=2/C=C3/c4nc5cccc(O)c5cc4CN3C(=O)C=2COC1=O
(2)InChI: InChI=1/C20H16N2O5/c1-2-20(26)13-7-15-17-10(6-11-14(21-17)4-3-5-16(11)23)8-22(15)18(24)12(13)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1
(3)InChIKey: LCZZWLIDINBPRC-FQEVSTJZBC
(4)Std. InChI: InChI=1S/C20H16N2O5/c1-2-20(26)13-7-15-17-10(6-11-14(21-17)4-3-5-16(11)23)8-22(15)18(24)12(13)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1
(5)Std. InChIKey: LCZZWLIDINBPRC-FQEVSTJZSA-N