N~5~-(7-chloroquinolin-4-yl)-N~1~,N~1~-diethylhexane-1,5-diamine 5430-89-7 CAS NO.5430-89-7

Min.Order: 1 Gram
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Product Details

Keywords

N-(7-chloroquinolin-4-yl)-N,N-diethyl-hexane-1,5-diamine
5430-89-7
98%

Quick Details

ProName: N~5~-(7-chloroquinolin-4-yl)-N~1~,N~1~...
CasNo: 5430-89-7
Molecular Formula: C19H28ClN3
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to 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

【Name】
N~5~-(7-chloroquinolin-4-yl)-N~1~,N~1~-diethylhexane-1,5-diamine
【CAS Registry number】
5430-89-7
【Synonyms】
1,5-hexanediamine, N~5~-(7-chloro-4-quinolinyl)-N~1~,N~1~-diethyl-
【Molecular Formula】
C19H28ClN3 (Products with the same molecular formula)
【Molecular Weight】
333.8987
【Inchi】
InChI=1/C19H28ClN3/c1-4-23(5-2)13-7-6-8-15(3)22-18-11-12-21-19-14-16(20)9-10-17(18)19/h9-12,14-15H,4-8,13H2,1-3H3,(H,21,22)
【Canonical SMILES】
CCN(CC)CCCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl
【MOL File】
5430-89-7.mol
Chemical and Physical Properties
【Density】
1.097g/cm3
【Boiling Point】
472.5°C at 760 mmHg
【Refractive Index】
1.585
【Flash Point】
239.6°C
【Computed Properties】
Molecular Weight:333.89872 [g/mol]
Molecular Formula:C19H28ClN3
XLogP3:5
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:9
Tautomer Count:3
Exact Mass:333.197176
MonoIsotopic Mass:333.197176
Topological Polar Surface Area:28.2
Heavy Atom Count:23
Formal Charge:0
Complexity:322
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Cation Count:2
Feature 3D Ring Count:2
Effective Rotor Count:9
Conformer Sampling RMSD:1
CID Conformer Count:197

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