Basic information
- CAS
86901-30-6- Standard SMILES
CC1=C(C)C(C)c2c(C)c(C)c(C)c(C)c21- InChIKey
GKSNDWDOQMJOIT-UHFFFAOYSA-N- Molecular formula
- C16H22
- Average molar mass
- 214.35 g/mol
- Monoisotopic mass
- 214.1721507
Names & identifiers
- Preferred name
- 1,2,3,4,5,6,7-Heptamethyl-1H-indene
- IUPAC
- 1,2,3,4,5,6,7-heptamethyl-1H-indene
- English name
- 1,2,3,4,5,6,7-HEPTAMETHYLINDENE
- Molecular formula
- C16H22
- Molecular weight
- 214.35
Names & synonyms
1,2,3,4,5,6,7-HEPTAMETHYL-1H-INDENE86901-30-6DTXSID50507195RefChem:214281DTXCID60458003heptamethylindeneSCHEMBL1939433SCHEMBL70097321,2,3,4,5,6,7-HEPTAMETHYLINDENE1H-Indene, 1,2,3,4,5,6,7-heptamethyl-1,2,3,4,5,6,7-Heptamethylindene,min.98%1,2,3,4,5,6,7-HEPTAMETHYLINDENE, MIN. 98%
Database identifiers
- CAS
86901-30-6- PubChem CID
- 12696161
- DTXSID
DTXSID50507195- Nikkaji
- J1.137.267H
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Melting point
- 54 · 54-56°C
- Boiling point
- 322.8 · 322.8±37.0 °C(Predicted)
- Density
- 0.92 · 0.920±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海杰股生物科技有限公司021-51698675 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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