6-hydroxy-1H-indazole

HCID 135483987CAS 23244-88-4

Basic information

Standard SMILES
Oc1ccc2cn[nH]c2c1
InChIKey
NUYZVDBIVNOTSC-UHFFFAOYSA-N
Molecular formula
C7H6N2O
Average molar mass
134.14 g/mol
Monoisotopic mass
134.04801281

Overview

has neuroprotective activity; structure in first source

Names & identifiers

Preferred name
6-hydroxy-1H-indazole
IUPAC
1H-indazol-6-ol
English name
6-Hydroxyindazole
Molecular formula
C7H6N2O
Molecular weight
134.14

Names & synonyms

6-Hydroxy-1H-indazoleRefChem:798361H-Indazol-6-ol6-Hydroxyindazole23244-88-46-Indazolol1,2-dihydroindazol-6-oneIndazole, 6-hydroxy-MFCD000227881,2-Dihydro-6H-indazol-6-one1935152-48-9EINECS 245-519-5
Show more names
indazol-6-ol6-Hydroxy-1H-indazoL6-Hydroxyindazole>1,2-dihydroindazol-6-one1H-Indazol-6-ol (6CI, 8CI, 9CI, ACI)
NSC 92744BRN 00032156-Isoindazolol6-Hydroxyindazol2K4NSC92744indazol-6(1h)-oneBAS 00226160

Database identifiers

CAS
23244-88-4
PubChem CID
135483987
DTXSID
DTXSID70901318
EC Number
245-519-5
Nikkaji
J41.018G

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
48.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
10

Physicochemical properties

Melting point
217 to · 217.0 to 221.0 °C
Boiling point
366.5 · 366.5±15.0 °C(Predicted)
Density
1.434 · 1.434±0.06 g/cm3(Predicted)
storage temp.
Inert atmosphere,Room Temperature
solubility
soluble in Methanol
form
powder to crystal

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 2 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

wgk
3
rtecs
NK8010000
hs_code
2933998090
Toxicity
mouse,LD50,intravenous,180mg/kg (180mg/kg),U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04549,
risk_code
22
Signal word
Warning

Chemistry & industry

Applications · 1 item

Uses6-Hydroxyinazole is a light brown powder and an important pharmaceutical intermediate used to construct the core of active drug molecules. It has broad application prospects in the synthesis and screening of small molecule chemical drugs. 6-Hydroxyinazole has neuroprotective effects. Indazole and its derivatives possess various biological activities, such as anti-inflammatory, antitumor, antioxidant, hypoglycemic, anti-HIV, anti-tuberculosis, antiplatelet, and 5-HT3 receptor antagonism. In addition, indazole derivatives are widely used in herbicides and dyes. Indazole was originally defined as a "pyrazole-ringed benzene ring," belonging to the azole family. It contains only three elements: carbon, hydrogen, and oxygen, and is an aromatic heterocycle containing 10 electrons. Theoretically, depending on whether there are hydrogen atoms on the two nitrogen atoms, indazole exists in two tautomeric forms: 1H-indazole and 2H-indazole. When there are no substituents on the indazole, it mainly exists in the 1H-indazole form.

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
环生美森医药技术(山东)有限公司0531-88762217 18301471076 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
常熟市海天医药原料有限公司13913622609
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Related reactions

21 records

Linked notes

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