CAS 201483-49-0 5-bromo-3-methoxy-1H-indazole (HCID 59831760)

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Basic information

CAS: 201483-49-0
Standard SMILES: COc1n[nH]c2ccc(Br)cc12
InChIKey: ABWHVHBGFZUYAA-UHFFFAOYSA-N
Molecular formula: C8H7BrN2O
Average molar mass: 227.06 g/mol
Monoisotopic mass: 225.97417494

Names & identifiers

Preferred name: 5-bromo-3-methoxy-1H-indazole
IUPAC: 5-bromo-3-methoxy-1H-indazole
English name: 1H-Indazole,5-broMo-3-Methoxy-
Molecular formula: C8H7BrN2O
Molecular weight: 227.06

Names & synonyms

5-Bromo-3-methoxy-1H-indazole201483-49-0DTXSID70733116RefChem:301798DTXCID30683860859-356-81H-INDAZOLE, 5-BROMO-3-METHOXY-MFCD13177005SCHEMBL2301858ABWHVHBGFZUYAA-UHFFFAOYSA-N1H-Indazole,5-broMo-3-Methoxy-AKOS015999399

Show more names

FS-3541PB33147SY258768DB-317471CS-0018983F211284F793362

Database identifiers

CAS: 201483-49-0
PubChem CID: 59831760
DTXSID: DTXSID70733116
EC Number: 859-356-8

Properties

Computed structural properties

XLogP: 2.5
Topological polar surface area: 37.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 167

Physicochemical properties

storage temp.: Sealed in dry,Room Temperature
Appearance: White to off-white Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H335
Precautionary statements: 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H335
Precautionary statements: P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362