Basic information
- CAS
6538-35-8- Standard SMILES
Cc1cc(C)c(O)c(Cc2cc(C)cc(C)c2O)c1- InChIKey
FCIMDZFOYJBMLV-UHFFFAOYSA-N- Molecular formula
- C17H20O2
- Average molar mass
- 256.34 g/mol
- Monoisotopic mass
- 256.14632988
Names & identifiers
- Preferred name
- 6,6'-Methylenedi-2,4-xylenol
- IUPAC
- 2-[(2-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol
- English name
- 6,6'-methylenedi-2,4-xylenol
- Molecular formula
- C17H20O2
- Molecular weight
- 256.34
Names & synonyms
6,6'-Methylenedi-2,4-xylenol6538-35-82-[(2-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethylphenol9X7XHT5AML2-((2-Hydroxy-3,5-dimethylphenyl)methyl)-4,6-dimethylphenolPhenol,2-[(2-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethyl-EINECS 229-451-32,4-Xylenol, 6,6'-methylenedi-6,6'-methylenebis(2,4-dimethylphenol)UNII-9X7XHT5AMLSCHEMBL69707DTXSID90215702
Show more names
Phenol, 2-[(2-hydroxy-3,5-dimethylphenyl)methyl]-4,6-dimethyl-
FCIMDZFOYJBMLV-UHFFFAOYSA-N2,2'-methylenebis(4,6-dimethylphenol)DB-127497NS000226292,2'-Dioxy-3,5,3',5'-tetramethyl-diphenylmethanPHENOL, 2-((2-HYDROXY-3,5-DIMETHYLPHENYL)METHYL)-4,6-DIMETHYL-
Database identifiers
- CAS
6538-35-8- PubChem CID
- 81029
- DTXSID
DTXSID90215702- UNII
- 9X7XHT5AML
- EC Number
- 229-451-3
- Nikkaji
- J225.174D
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 263
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 145 · 145-146 °C
- Boiling point
- 170 · 170-220 °C(Press: 1.5 Torr)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- pka
- 10.3 · 10.30±0.48(Predicted)
- FDA UNII
- 9 X7XHT5AML · 9X7XHT5AML
Chemistry & industry
Suppliers4 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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