Basic information
- CAS
29559-52-2- Standard SMILES
CC(C)(Cl)C(Cl)Cl- InChIKey
FRRHZKFKOHHEJR-UHFFFAOYSA-N- Molecular formula
- C4H7Cl3
- Average molar mass
- 161.45 g/mol
- Monoisotopic mass
- 159.961333
Names & identifiers
- Preferred name
- 1,1,2-Trichloro-2-methylpropane
- IUPAC
- 1,1,2-trichloro-2-methylpropane
- English name
- 1,1,2-TRICHLORO-2-METHYLPROPANE
- Molecular formula
- C4H7Cl3
- Molecular weight
- 161.46
Names & synonyms
1,1,2-Trichloro-2-methylpropane29559-52-2Propane, 1,1,2-trichloro-2-methyl-Propane,1,1,2-trichloro-2-methyl-1,1,2-trichloro-2-methyl-propaneSCHEMBL7954973SCHEMBL7954975FRRHZKFKOHHEJR-UHFFFAOYSA-DTXSID803343501,1,2-Trichloro-2-methylpropane #D92461InChI=1/C4H7Cl3/c1-4(2,7)3(5)6/h3H,1-2H3
Show more names
trichloromethylpropanetrichloro-2-methylpropaneIsobutane,1,1,2-trichloro1,1,2-TRICHLORO-2-METHYLPROPANE 98+%
Database identifiers
- CAS
29559-52-2- PubChem CID
- 520441
- DTXSID
DTXSID80334350- Nikkaji
- J209.033C
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 58
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- -6 °C · -6°C
- Boiling point
- 162 °C · 162 °C
- Density
- 1.28 · 1.28
- refractive index
- 1.464 · 1.4640-1.4670
- Flash point
- 73 °C · 73 °C
- CAS DataBase Reference
- 29559 · 29559-52-2
- Signal word
- Warning
- Hazard statements
- 227 · H227
- Precautionary statements
- 210 · P210-P280-P403+P235-P501
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
- Signal word
- Warning
- Hazard statements
- H227
- Precautionary statements
- P210-P280-P403+P235-P501
Chemistry & industry
Suppliers10 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
南通市苏北化工原料有限公司0513-85290972 18762756250 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
南通众合化工新材料有限公司0513-85666561 15950816326 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…