5418-80-4 CAS NO.5418-80-4

Min.Order: 1 Gram
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Product Details

Keywords

Quinolinium,2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-1-methyl-, iodide (1:1)
5418-80-4
98%

Quick Details

ProName: 5418-80-4
CasNo: 5418-80-4
Molecular Formula: C19H18 N O2 . I
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: as client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 10 Kilogram/Month
Purity: 99%
Storage: Room Temperature
Transportation: as requested
LimitNum: 1 Gram
Grade: Industrial Grade

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Details

Identification and Related Records
【Name】
Quinolinium,2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-1-methyl-, iodide (1:1)
【CAS Registry number】
5418-80-4
【Synonyms】
Quinolinium,2-(4-hydroxy-3-methoxystyryl)-1-methyl-, iodide (8CI)
Quinolinium,2-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-1-methyl-, iodide (9CI)
【Molecular Formula】
C19H18 N O2 . I (Products with the same molecular formula)
【Molecular Weight】
293.3597
【Inchi】
InChI=1/C19H19NO2/c1-20-16(11-9-15-5-3-4-6-17(15)20)10-7-14-8-12-18(21)19(13-14)22-2/h3-13,16,21H,1-2H3/b10-7+
【Canonical SMILES】
C[N+]1=C(C=CC2=CC=CC=C21)C=CC3=CC(=C(C=C3)O)OC.[I-]
【Isomers smiles】
C[N+]1=C(C=CC2=CC=CC=C21)C=CC3=CC(=C(C=C3)O)OC.[I-]
Chemical and Physical Properties
【Density】
1.216g/cm3
【Boiling Point】
462.9°Cat760mmHg
【Refractive Index】
1.689
【Flash Point】
233.8°C
【Computed Properties】
Molecular Weight:419.25619 [g/mol]
Molecular Formula:C19H18INO2
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:3
Tautomer Count:5
Exact Mass:419.038222
MonoIsotopic Mass:419.038222
Topological Polar Surface Area:33.3
Heavy Atom Count:23
Formal Charge:0
Complexity:384
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2

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