5-methoxy-1H-indazol-3-amine
Basic information
- CAS
58514-96-8- Standard SMILES
COc1ccc2[nH]nc(N)c2c1- InChIKey
BZMRACNPNBEQJQ-UHFFFAOYSA-N- Molecular formula
- C8H9N3O
- Average molar mass
- 163.18 g/mol
- Monoisotopic mass
- 163.07456192
Names & identifiers
- Preferred name
- 5-methoxy-1H-indazol-3-amine
- IUPAC
- 5-methoxy-1H-indazol-3-amine
- English name
- 5-methoxy-1H-indazol-3-amine
- Molecular formula
- C8H9N3O
- Molecular weight
- 163.18
Names & synonyms
5-methoxy-1H-indazol-3-amine58514-96-8DTXSID50602836RefChem:303681DTXCID70553593856-049-01H-Indazol-3-amine, 5-methoxy-MFCD106968383-Amino-5-methoxyindazole5-(Methyloxy)-1H-indazol-3-amine5-METHOXY-2H-INDAZOL-3-AMINESCHEMBL2436313
Show more names
BZMRACNPNBEQJQ-UHFFFAOYSA-NICA51496(5-Methoxy-1H-indazol-3-yl)amineAKOS005146474AKOS013464666AB58303SY146739DB-026353
Database identifiers
- CAS
58514-96-8- PubChem CID
- 20135754
- DTXSID
DTXSID50602836- EC Number
- 856-049-0
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 164
Physicochemical properties
- Melting point
- 170 · 170-172 °C
- Boiling point
- 406.3 · 406.3±25.0 °C(Predicted)
- Density
- 1.344 · 1.344
- pka
- 14.51 · 14.51±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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, 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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
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Compound notes
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