1-Methyl-1H-indazole-6-carbaldehyde
Basic information
- CAS
1092351-51-3- Standard SMILES
Cn1ncc2ccc(C=O)cc21- InChIKey
YVMQGPATHPKGOU-UHFFFAOYSA-N- Molecular formula
- C9H8N2O
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.06366288
Names & identifiers
- Preferred name
- 1-Methyl-1H-indazole-6-carbaldehyde
- IUPAC
- 1-methylindazole-6-carbaldehyde
- English name
- 1-Methyl-1H-indazole-6-carbaldehyde
- Molecular formula
- C9H8N2O
- Molecular weight
- 160.17
Names & synonyms
1-Methyl-1H-indazole-6-carbaldehyde1092351-51-31-methylindazole-6-carbaldehyde1-Methyl-1H-indazole-6-carboxaldehydeMFCD11109366SCHEMBL2138250DTXSID50653303PB34574PS-4758SY065446CS-0037487EN300-4274866
Show more names
1-methyl-6-indazolecarboxaldehyde1-Methyl-1H-indazol-6-carbaldehyde1H-Indazole-6-carboxaldehyde, 1-methyl-
Z11983122546-Formyl-1-methyl-1H-indazoleFT-06854996-Formyl-1-methyl-1H-indA801988SCHEMBL29570479AKOS005258493DB-059822
Database identifiers
- CAS
1092351-51-3- PubChem CID
- 37818596
- DTXSID
DTXSID50653303- EC Number
- 640-555-1
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Density
- 1.21 · 1.21
- Flash point
- 142.4 ℃ · 142.4℃
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332-H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Risk Statements
- 20 · 20/21/22-36/37/38
- Safety Statements
- 36 · 36/37/39-45
- 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Safety data
- hs_code
- 2933998090
- risk_code
- 20/21/22-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 36/37/39-45
- Hazard statements
- H302+H312+H332-H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Applications
Uses1-Methyl-1H-indazole-6-carbaldehyde is employed as a component in drug development, particularly for its possible contribution to the discovery of novel therapeutic agents.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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