Basic information
- CAS
53209-24-8- Standard SMILES
COC1(C)CCc2c(C)c(O)c(C)c(C)c2O1- InChIKey
KCTHYRRQQNMFKC-UHFFFAOYSA-N- Molecular formula
- C14H20O3
- Average molar mass
- 236.31 g/mol
- Monoisotopic mass
- 236.1412445
Names & identifiers
- Preferred name
- 2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-
- IUPAC
- 2-methoxy-2,5,7,8-tetramethyl-3,4-dihydrochromen-6-ol
- English name
- 2H-1-Benzopyran-6-ol,3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-
- Molecular formula
- C14H20O3
- Molecular weight
- 236.31
Names & synonyms
2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-(+-)-2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-RefChem:48418453209-24-82-methoxy-2,5,7,8-tetramethylchroman-6-ol3,4-Dihydro-2-methoxy-2,5,7,8-tetramethyl-2H-1-benzopyran-6-ol6-hydroxy-2-methoxy-2,5,7,8-tetramethylchromanSCHEMBL7327753DTXSID408860422-Methoxy-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-olG83620F556034
Show more names
2H-1-Benzopyran-6-ol,3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-
(+/-)-6-hydroxy-2-methoxy-2,5,7,8-tetramethylchroman(+/- )-6-hydroxy-2-methoxy-2,5,7,8-tetramethylchroman(+/-)-6-hydroxy- 2-methoxy-2,5,7,8-tetramethylchroman(+/-)-6-hydroxy-2-methoxy-2,5,7,8 -tetramethylchroman(+/-)-6-hydroxy-2-methoxy-2,5,7,8-tetra-methylchroman
Database identifiers
- CAS
53209-24-8- PubChem CID
- 103763
- DTXSID
DTXSID40886042- Nikkaji
- J2.479.226I
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 281
Physicochemical properties
- Melting point
- 156 °C · 156 °C(Solv: methanol (67-56-1))
- Boiling point
- 363 · 363.0±42.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- pka
- 11.28 · 11.28±0.40(Predicted)
- EPA Substance Registry System
- 2 H-1-Benzopyran-6-ol, · 2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl- (53209-24-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2H-1-Benzopyran-6-ol, 3,4-dihydro-2-methoxy-2,5,7,8-tetramethyl-: INACTIVE
Suppliers1 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
20 records
Compound notes
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