Quinoline, 2-[2-(4-bromophenyl)ethenyl]- 5396-94-1 CAS NO.5396-94-1

Min.Order: 1 Gram
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Product Details

Keywords

Quinoline, 2-[2-(4-bromophenyl)ethenyl]-
5396-94-1
98%

Quick Details

ProName: Quinoline, 2-[2-(4-bromophenyl)ethenyl...
CasNo: 5396-94-1
Molecular Formula: C17H12 Br N
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: as client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: Room Temperature
Transportation: as requested
LimitNum: 1 Gram
Heavy metal: N/A
Grade: Industrial Grade

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Details

Identification and Related Records
【Name】
Quinoline, 2-[2-(4-bromophenyl)ethenyl]-
【Iupac name】
2-[2-(4-bromophenyl)ethenyl]quinoline
【CAS Registry number】
5396-94-1
【Synonyms】
NSC4405
【Molecular Formula】
C17H12 Br N (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C17H12BrN/c18-15-9-5-13(6-10-15)7-11-16-12-8-14-3-1-2-4-17(14)19-16/h1-12H
【InChIKey】
GNFDGJRVTZZWFA-YRNVUSSQSA-N
【Canonical SMILES】
C1=CC=C2C(=C1)C=CC(=N2)C=CC3=CC=C(C=C3)Br
【MOL File】
5396-94-1.mol
Chemical and Physical Properties
【Density】
1.434g/cm3
【Boiling Point】
435.7°C at 760 mmHg
【Refractive Index】
1.741
【Flash Point】
217.3°C
【Computed Properties】
Molecular Weight:310.18788 [g/mol]
Molecular Formula:C17H12BrN
XLogP3:5.2
H-Bond Donor:0
H-Bond Acceptor:1
Rotatable Bond Count:2
Exact Mass:309.015312
MonoIsotopic Mass:309.015312
Topological Polar Surface Area:12.9
Heavy Atom Count:19
Formal Charge:0
Complexity:306
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:1
Feature 3D Acceptor Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:3
Effective Rotor Count:2
Conformer Sampling RMSD:0.6
CID Conformer Count:3

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