Basic information
- CAS
3141-45-5- Standard SMILES
CC1(C)C(C)(C)C1(Cl)Cl- InChIKey
NYAXETYROCUVOQ-UHFFFAOYSA-N- Molecular formula
- C7H12Cl2
- Average molar mass
- 167.07 g/mol
- Monoisotopic mass
- 166.0316058
Overview
structure given in first source
Names & identifiers
- Preferred name
- 1,1-Dichloro-2,2,3,3-tetramethylcyclopropane
- IUPAC
- 1,1-dichloro-2,2,3,3-tetramethylcyclopropane
- English name
- 1,1-dichloro-2,2,3,3-tetramethylcyclopropane
- Molecular formula
- C7H12Cl2
- Molecular weight
- 167.08
Names & synonyms
1,1-Dichloro-2,2,3,3-tetramethylcyclopropaneDctmcp3141-45-5Cyclopropane, 1,1-dichloro-2,2,3,3-tetramethyl-59QC7G2QXSNSC-139886DTXSID10185337RefChem:71031DTXCID20107828NSC 139886UNII-59QC7G2QXSCyclopropane,1,1-dichloro-2,2,3,3-tetramethyl-
Show more names
SCHEMBL1350471,1,2,2-TETRAMETHYL-3,3-DICHLOROCYCLOPROPANENYAXETYROCUVOQ-UHFFFAOYSA-NNSC139886DS-0107361,1-dichloro-2,2,3,3-tetramethyl-cyclopropane1,1-Dichloro-2,2,3,3-tetramethylcyclopropane #
Database identifiers
- CAS
3141-45-5- PubChem CID
- 97646
- DTXSID
DTXSID10185337- UNII
- 59QC7G2QXS
- Nikkaji
- J1.149.727F
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 129
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physicochemical properties
- Melting point
- 49.8 · 49.8-50.5 °C
- Boiling point
- 48 °C · 48 °C(Press: 10 Torr)
- Density
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- FDA UNII
- 59 QC7G2QXS · 59QC7G2QXS
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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