6-Bromo-3-chloro-1H-indazole
Basic information
- CAS
885271-78-3- Standard SMILES
Clc1[nH]nc2cc(Br)ccc12- InChIKey
LDBXLSQSRZCYHL-UHFFFAOYSA-N- Molecular formula
- C7H4BrClN2
- Average molar mass
- 231.48 g/mol
- Monoisotopic mass
- 229.92464
Names & identifiers
- Preferred name
- 6-Bromo-3-chloro-1H-indazole
- IUPAC
- 6-bromo-3-chloro-2H-indazole
- English name
- 6-BROMO-3-CHLORO-1H-INDAZOLE
- Molecular formula
- C7H4BrClN2
- Molecular weight
- 231.48
Names & synonyms
6-Bromo-3-chloro-1H-indazole885271-78-3RefChem:540869687-904-46-bromo-3-chloro-2H-indazoleMFCD06738283SCHEMBL15288471DTXSID30646556SC1851AKOS005073913CS-W003328PB20195
Show more names
3-Chloro-6-broMoindazole6-BROMO-3-CHLORO INDAZOLE1H-INDAZOLE,6-BROMO-3-CHLORO-
PS-5134SY0205446-Bromo-3-chloro-1H-indazole, 885271-78-3, 1H-Indazole,6-bromo-3-chloro-, PubChem20688, CTK5G0239, 6-BROMO-3-CHLORO INDAZOLE, ANW-50020, SBB097801, SC1851, ZINC14984927, AKOS005073913, AG-H-56971, PB20195, QC-5190, RP05566, SS-5039, AK-28206, BR-28206, KB-44858, AM20050386AM20050386FT-0681741SCHEMBL31539770SBB097801F077041
Database identifiers
- CAS
885271-78-3- PubChem CID
- 24728895
- DTXSID
DTXSID30646556- EC Number
- 687-904-4
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 155
Physicochemical properties
- Density
- 1.878 · 1.878
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338-P310
Suppliers
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Related reactions
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Compound notes
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