(+/-)-Cryptostyline III supplier

Name
(+/-)-Cryptostyline III
EINECS
CAS No. 22324-83-0
Article Data6
CAS DataBase
Density 1.126 g/cm³
Solubility
Melting Point 140-141 °C
Formula C₂₁H₂₇NO₅
Boiling Point 462.5 °C at 760 mmHg
Molecular Weight 373.449
Flash Point 128 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Isoquinoline,1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-, (?à)- (8CI);(?à)-Cryptostyline III;
PSA 49.39000
LogP 3.24480

(+/-)-Cryptostyline III Specification

The (+/-)-Cryptostyline III is an organic compound with the formula C₂₁H₂₇NO₅. The systematic name of this chemical is 6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline. With the CAS registry number 22324-83-0, it is also named as 1,2,3,4-Tetrahydro-6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxyphenyl)isoquinoline.

Physical properties about (+/-)-Cryptostyline III are: (1)ACD/LogP: 2.58; (2)#H bond acceptors: 6; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 49.39 Å²; (5)Index of Refraction: 1.543; (6)Molar Refractivity: 104.53 cm³; (7)Molar Volume: 331.5 cm³; (8)Polarizability: 41.44×10^-24cm³; (9)Surface Tension: 38.1 dyne/cm; (10)Density: 1.126 g/cm³; (11)Flash Point: 128 °C; (12)Enthalpy of Vaporization: 72.35 kJ/mol; (13)Boiling Point: 462.5 °C at 760 mmHg; (14)Vapour Pressure: 9.85E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1cc(cc(OC)c1OC)C3c2c(cc(OC)c(OC)c2)CCN3C)C
(2)InChI: InChI=1/C21H27NO5/c1-22-8-7-13-9-16(23-2)17(24-3)12-15(13)20(22)14-10-18(25-4)21(27-6)19(11-14)26-5/h9-12,20H,7-8H2,1-6H3
(3)InChIKey: WAXADPYOTKIQBY-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C21H27NO5/c1-22-8-7-13-9-16(23-2)17(24-3)12-15(13)20(22)14-10-18(25-4)21(27-6)19(11-14)26-5/h9-12,20H,7-8H2,1-6H3
(5)Std. InChIKey: WAXADPYOTKIQBY-UHFFFAOYSA-N

Product Name

(+/-)-Cryptostyline III

(+/-)-Cryptostyline III Specification

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