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8-Isoquinolinol(CAS No. 3482-14-2)

8-Isoquinolinol C9H7NO (cas 3482-14-2) Molecular Structure

3482-14-2 Structure

Identification and Related Records

【Name】
8-Isoquinolinol
【Iupac name】
2H-isoquinolin-8-one
【CAS Registry number】
3482-14-2
【Synonyms】
8-Hydroxyisoquinoline
NSC 400234
Isoquinolin-8-ol
【Molecular Formula】
C9H7NO (Products with the same molecular formula)
【Molecular Weight】
145.16
【Inchi】
InChI=1/C9H7NO/c11-9-3-1-2-7-4-5-10-6-8(7)9/h1-6,11H
【Canonical SMILES】
C1=CC(=O)C2=CNC=CC2=C1
【MOL File】
3482-14-2.mol

Chemical and Physical Properties

【Appearance】
white solid
【Density】
1.23 g/cm3
【Boiling Point】
427 °C at 760 mmHg
【Refractive Index】
1.691
【Flash Point】
213.2 °C
【Computed Properties】
Molecular Weight:145.15798 [g/mol]
Molecular Formula:C9H7NO
XLogP3-AA:1
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:0
Tautomer Count:3
Exact Mass:145.052764
MonoIsotopic Mass:145.052764
Topological Polar Surface Area:29.1
Heavy Atom Count:11
Formal Charge:0
Complexity:319
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
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:1
Feature 3D Ring Count:2
Effective Rotor Count:0
Conformer Sampling RMSD:0.4
CID Conformer Count:1

Safety and Handling

【Hazard Codes】
Xi: Irritant;
【Hazard Note】
Irritant
【Safety】

Hazard Codes: IrritantXi
Hazard Note: Irritant

【Specification】

 8-Isoquinolinol , its cas register number is 3482-14-2. It also can be called 8-Hydroxyisoquinoline ; Isoquinolin-8-ol ; 8-Isoquinolinol(6CI,7CI,8CI,9CI) ; 2H-isoquinolin-8-one .

Supplier Location

Top Suppliers

Diamond member Shanghai Do Chemical Co.,Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-21-33758180
Diamond member Hangzhou Dayangchem Co., Ltd.
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Telephone:86-571-88938639
Diamond member Nanjing Chemlin Chemical Co., Ltd.
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Telephone:86-25-83697070
Diamond member AOPHARM
Country:ChinaChina
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Telephone:86-311-66600578
Diamond member Hangzhou J&H Chemical Co., Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-87396430
Finetech Industry limited.
Country:ChinaChina
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Telephone:86-27-87465837
Capot Chemical Co., Ltd.
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Telephone:86-571-85586718
Shanghai Hope Chem Co., Ltd.
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Telephone:86-21-61723543
Atomax Chemicals Co.,Ltd
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Telephone:86-755-33239182
Shijiazhuang Sdyano Fine Chemical Co., Ltd
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Business Type:Manufacturer
Telephone:86-311-80800737

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