Indano[2,1-d]1,3-dioxane,
Basic information
- CAS
102688-70-0- Standard SMILES
c1ccc2c(c1)CC1OCOCC21- InChIKey
PAWMBLGFZJZYDI-UHFFFAOYSA-N- Molecular formula
- C11H12O2
- Average molar mass
- 176.21 g/mol
- Monoisotopic mass
- 176.08372962
Names & identifiers
- Preferred name
- Indano[2,1-d]1,3-dioxane,
- IUPAC
- 4,4a,9,9a-tetrahydroindeno[2,1-d][1,3]dioxine
Names & synonyms
Indano[2,1-d]1,3-dioxane,DTXSID50880677102688-70-0Indano(2,1-d)1,3-dioxane,RefChem:349035DTXCID001022043PAWMBLGFZJZYDI-UHFFFAOYSA-N4,4a,9,9a-Tetrahydroindeno[2,1-d][1,3]dioxineSCHEMBL5926636AKOS005593380ST4033729NS00096135
Show more names
2H,4H,4aH,9aH-indano[2,1-d]1,3-dioxaneAG-205/127618774,4a,9,9a-Tetrahydroindeno[2,1-d][1,3]dioxine #4,4a,9,9a-Tetrahydro-2H-indeno[2,1-d][1,3]dioxine
Database identifiers
- CAS
102688-70-0- PubChem CID
- 575459
- DTXSID
DTXSID50880677
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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