[3-(2-Methyl-1,3-thiazol-4-yl)phenyl]methanol
Basic information
- CAS
850375-06-3- Standard SMILES
Cc1nc(-c2cccc(CO)c2)cs1- InChIKey
KDZJEQBWBSZOEG-UHFFFAOYSA-N- Molecular formula
- C11H11NOS
- Average molar mass
- 205.28 g/mol
- Monoisotopic mass
- 205.05613515
Names & identifiers
- Preferred name
- [3-(2-Methyl-1,3-thiazol-4-yl)phenyl]methanol
- IUPAC
- [3-(2-methyl-1,3-thiazol-4-yl)phenyl]methanol
- English name
- [3-(2-Methyl-1,3-thiazol-4-yl)phenyl]methanol
- Molecular formula
- C11H11NOS
- Molecular weight
- 205.28
Names & synonyms
850375-06-3[3-(2-methyl-1,3-thiazol-4-yl)phenyl]methanol(3-(2-Methylthiazol-4-yl)phenyl)methanolMFCD026820663-(2-Methyl-4-thiazolyl)benzenemethanol3-(2-Methyl-4-thiazolyl)benzyl Alcohol3-(2-Methyl-1,3-thiazol-4-yl)benzyl alcohol[3-(2-methylthiazol-4-yl)phenyl]methanol(3-(2-methyl-1,3-thiazol-4-yl)phenyl)methanolSCHEMBL3052495DTXSID00427798AKOS016010082
Show more names
[3-(2-Methyl-1,3-thiazol-4-yl)phenyl]methanol97%[3-(2-Methyl-1,3-thiazol-4-yl)phenyl]methanol 97%(3-(2-Methylthiazol-4-yl)phenyl)methanol - [M89215]
AB87220PS-3710BL007818SY064572[3-(2-methyl-4-thiazolyl)phenyl]methanolDB-056841Benzenemethanol, 3-(2-methyl-4-thiazolyl)-CS-0456258
Database identifiers
- CAS
850375-06-3- PubChem CID
- 7127783
- DTXSID
DTXSID00427798
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Melting point
- 77 · 77-79°C
- Boiling point
- 370.8 · 370.8±22.0 °C(Predicted)
- Density
- 1.225 · 1.225±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 14.1 · 14.10±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/37/38-22
- Safety Statements
- 22 · 22-26-36/37/39
- Hazard Note
- Irritant
- HS Code
- 2934100090 · 2934100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2934100090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- hazard_note
- Irritant
- safety_code
- 22-26-36/37/39
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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