Basic information
- CAS
18102-31-3- Standard SMILES
COc1c(C)cccc1O- InChIKey
SHESIBIEPSTHMZ-UHFFFAOYSA-N- Molecular formula
- C8H10O2
- Average molar mass
- 138.16 g/mol
- Monoisotopic mass
- 138.06807956
Names & identifiers
- Preferred name
- 2-Methoxy-3-methylphenol
- IUPAC
- 2-methoxy-3-methylphenol
- English name
- 2-Methoxy-3-methylphenol
- Molecular formula
- C8H10O2
- Molecular weight
- 138.16
Names & synonyms
2-Methoxy-3-methylphenol18102-31-33-MethylguaiacolPhenol, 2-methoxy-3-methyl-m-Cresol, 2-methoxy-UNII-06PSW1BPI206PSW1BPI2DTXSID10171058RefChem:878142-Methoxy-2-methyl PhenolDTXCID1093549605-912-8
Show more names
SHESIBIEPSTHMZ-UHFFFAOYSA-NMFCD169986962-Methoxy-3-methylphenol; 3-Methylguaiacol;methylmethoxyphenol2-methoxy-3-methyl-phenol2-Methoxy-3-methylphenol #SCHEMBL557811orb1986763
Database identifiers
- CAS
18102-31-3- PubChem CID
- 87455
- DTXSID
DTXSID10171058- UNII
- 06PSW1BPI2
- EC Number
- 605-912-8
- Nikkaji
- J141.494A
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 103
Physicochemical properties
- Melting point
- 37 · 37-38 °C
- Boiling point
- 100 · 100-110 °C(Press: 2 Torr)
- Density
- 1.078 · 1.078±0.06 g/cm3(Predicted)
- pka
- 10.08 · 10.08±0.10(Predicted)
- form
- liquid
- color
- Red
- FDA UNII
- 6 PSW1BPI2 · 06PSW1BPI2
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H315-H319-H332-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- HS Code
- 2909500090 · 2909500090
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
- 2909500090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H312-H315-H319-H332-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Applications
Uses2-Methoxy-3-methylphenol is a found in the thermal degredation of lignans.
Upstream & downstream products
Upstream raw materials
Suppliers18 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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