Basic information
- CAS
14398-71-1- Standard SMILES
CC1CCC2CCCCC2C1- InChIKey
GREARFRXIFVLGB-UHFFFAOYSA-N- Molecular formula
- C11H20
- Average molar mass
- 152.28 g/mol
- Monoisotopic mass
- 152.15650064
Names & identifiers
- Preferred name
- 2-Methyldecalin
- IUPAC
- 2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
- English name
- Naphthalene,decahydro-2-methyl-
- Molecular formula
- C11H20
- Molecular weight
- 152.28
Names & synonyms
2-Methyldecalin2958-76-1Naphthalene, decahydro-2-methyl-2-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthaleneDTXSID208733142MethyldecalinRefChem:476039DTXCID50820811Decahydro-2-methylnaphthaleneNAPHTHALENE,DECAHYDRO-2-METHYL-2-Methyldecahydronaphthalene2-METHYL-DECAHYDRONAPHTHALENE
Show more names
14398-71-1trans-Decalin, 2-methyl-2-Methyldecahydronaphthalene #SCHEMBL2252062SCHEMBL3182540SCHEMBL40608803-methylbicyclo[4.4.0]decaneGREARFRXIFVLGB-UHFFFAOYSA-N
Database identifiers
- CAS
14398-71-1、2958-76-1- PubChem CID
- 94249
- DTXSID
DTXSID20873314- Nikkaji
- J100.020I
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 128
Experimental & physicochemical properties
SolventsSolvents -> Aliphatics, Saturated (<C12)
SpringerMaterials PropertiesDensity
Physicochemical properties
- Boiling point
- 209.79 °C · 209.79°C (estimate)
- Density
- 0.8856 · 0.8856 (estimate)
- refractive index
- 1.4764 · 1.4764 (estimate)
- storage temp.
- Store at room temperature
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- 40.6 ug/L · 40.6ug/L(25 ºC)
- LogP
- 5.42 · 5.420 (est)
- EPA Substance Registry System
- -2 · Naphthalene, decahydro-2-methyl- (2958-76-1)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummarySee Decahydronaphthalene.
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers8 total
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
Wuhan Jingkang en Biomedical Technology Co., Ltd+86-0086-13720134139 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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