(3-methyl-1H-pyrazol-5-yl)methanol
Basic information
- CAS
17607-71-5- Standard SMILES
Cc1cc(CO)n[nH]1- InChIKey
SYDSMFCVIJNHEN-UHFFFAOYSA-N- Molecular formula
- C5H8N2O
- Average molar mass
- 112.13 g/mol
- Monoisotopic mass
- 112.06366288
Names & identifiers
- Preferred name
- (3-methyl-1H-pyrazol-5-yl)methanol
- IUPAC
- (5-methyl-1H-pyrazol-3-yl)methanol
- English name
- (3-methyl-1H-pyrazol-5-yl)methanol
- Molecular formula
- C5H8N2O
- Molecular weight
- 112.12982
Names & synonyms
(3-methyl-1H-pyrazol-5-yl)methanol17607-71-5RefChem:400374844-999-929004-73-7(5-methyl-1H-pyrazol-3-yl)methanol5-METHYL-1H-PYRAZOLE-3-METHANOL1H-Pyrazole-3-methanol, 5-methyl-MFCD00159583ZINC38518401H-pyrazole-5-methanol, 3-methyl-MFCD06661318
Show more names
(5-methyl-1H-pyrazole-3-yl)methanol3(5)-hydroxymethyl-5(3)-methyl pyrazole(3-Methyl-1H-Pyrazol-5-Yl)Methanol(WX640223)
(3-methylpyrazol-5-yl)methan-1-olCc1cc((nH)n1)COCC1=CC(=NN1)CO5METHYLPYRAZOLE3METHANOLSCHEMBL3465530SCHEMBL3626143SCHEMBL11740746SCHEMBL17633608
Database identifiers
- CAS
17607-71-5- PubChem CID
- 730093
- EC Number
- 844-999-9
- Nikkaji
- J1.854.133E
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 76.8
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HazardClass
- IRRITANT
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
H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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. 5 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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