Basic information
- CAS
6329-01-7- Standard SMILES
COc1cc(C2OCCC(C)O2)ccc1O- InChIKey
ZVJUAEJHNVXHHC-UHFFFAOYSA-N- Molecular formula
- C12H16O4
- Average molar mass
- 224.25 g/mol
- Monoisotopic mass
- 224.10485899
Names & identifiers
- Preferred name
- Phenol, 2-methoxy-4-(4-methyl-1,3-dioxan-2-yl)-
- IUPAC
- 2-methoxy-4-(4-methyl-1,3-dioxan-2-yl)phenol
- English name
- 2-methoxy-4-(4-methyl-1,3-dioxan-2-yl)phenol
- Molecular formula
- C12H16O4
- Molecular weight
- 224.25304
Names & synonyms
2-Methoxy-4-(4-methyl-1,3-dioxan-2-yl)phenol6329-01-7Vanillin 1,3-butylene glycol acetalPhenol, 2-methoxy-4-(4-methyl-1,3-dioxan-2-yl)-DTXSID30884259Phenol, 2-methoxy-4-(4-methyl-m-dioxan-2-yl)-EINECS 228-700-3NSC 44028AI3-20468RefChem:172767DTXCID101023713Phenol, 2-methoxy-4-(4-methyl-m-dioxan-2-yl)-(8CI)
Show more names
Phenol, 2-methoxy-4-(4-methyl-m-dioxan-2-yl)- (8ci)
228-700-3Phenol,3-dioxan-2-yl)-SCHEMBL11913915ZVJUAEJHNVXHHC-UHFFFAOYSA-NNSC44028NSC-44028NS00044194
Database identifiers
- CAS
6329-01-7- PubChem CID
- 97816
- DTXSID
DTXSID30884259- EC Number
- 228-700-3
- Nikkaji
- J206.928H
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 221
Physicochemical properties
- LogP
- 1.607 · 1.607 (est)
- EPA Substance Registry System
- 2 · Phenol, 2-methoxy-4-(4-methyl-1,3-dioxan-2-yl)- (6329-01-7)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 2-methoxy-4-(4-methyl-1,3-dioxan-2-yl)-: INACTIVE
Suppliers1 total
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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