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19493-45-9

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19493-45-9 Structure

19493-45-9 Structure
IdentificationBack Directory
[Name]

3-Chloroisoquinoline
[CAS]

19493-45-9
[Synonyms]

3-Chloroisoquinoline
Isoquinoline, 3-chloro-
3-Chloroisoquinoline98%
3-Chloroisoquinoline 98%
3-Chloro-2-azanaphthalene
3-Chloroisoquinoline ISO 9001：2015 REACH
[Molecular Formula]

C9H6ClN
[MDL Number]

MFCD05982009
[MOL File]

19493-45-9.mol
[Molecular Weight]

163.604
Chemical PropertiesBack Directory
[Melting point ]

45-46 °C
[Boiling point ]

291.8±13.0 °C(Predicted)
[density ]

1.270±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

Solid
[pka]

1.84±0.30(Predicted)
[Appearance]

White to light yellow Solid
[InChI]

InChI=1S/C9H6ClN/c10-9-5-7-3-1-2-4-8(7)6-11-9/h1-6H
[InChIKey]

CPCMFADZMOYDSZ-UHFFFAOYSA-N
[SMILES]

C1C2=C(C=CC=C2)C=C(Cl)N=1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H332-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
[Hazard Codes ]

Xi
[Hazard Note ]

Irritant
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

3-Chloroisoquinoline(19493-45-9)1HNMR
Hazard InformationBack Directory
[References]

[1] Patent: WO2010/45401, 2010, A1. Location in patent: Page/Page column 88
[2] Patent: WO2010/45402, 2010, A1. Location in patent: Page/Page column 87
[3] Patent: US2005/113576, 2005, A1. Location in patent: Page/Page column 30
[4] Chemische Berichte, 1886, vol. 19, p. 1655,2356
[5] Chemische Berichte, 1886, vol. 19, p. 1655,2356
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