Basic information
- CAS
594-20-7- Standard SMILES
CC(C)(Cl)Cl- InChIKey
ZEOVXNVKXIPWMS-UHFFFAOYSA-N- Molecular formula
- C3H6Cl2
- Average molar mass
- 112.98 g/mol
- Monoisotopic mass
- 111.9846556
Overview
a water pollutant
Names & identifiers
- Preferred name
- 2,2-Dichloropropane
- IUPAC
- 2,2-dichloropropane
- English name
- 2,2-DICHLOROPROPANE
- Molecular formula
- C3H6Cl2
- Molecular weight
- 112.99
Names & synonyms
2,2-DICHLOROPROPANE594-20-7Propane, 2,2-dichloro-DimethyldichloromethaneDichlorodimethylmethaneR 270aaDTXSID7030060C5V432N6XBDTXCID5010060RefChem:80989209-832-0MFCD00000812
Show more names
propane,2,2-dichloror270aa2,2-dichloro-propanpropane,2,2-dichloro-2,2-Dichloropropane,98%
2,2-Dichloropropane StandardAcetone DichlorideCAS-594-20-7CCRIS 9221Isopropylidene ChlorideDichloropropane, 2,2-EINECS 209-832-0UNII-C5V432N6XB
Database identifiers
- CAS
594-20-7- PubChem CID
- 11660
- DTXSID
DTXSID7030060- ChEMBL
CHEMBL349587- UNII
- C5V432N6XB
- EC Number
- 209-832-0
- Nikkaji
- J3.646C
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 27.9
Experimental & physicochemical properties
Chemical ClassesVolatile Organic Compound (VOC)
SolventsSolvents -> Chlorinated Aliphatics
SpringerMaterials PropertiesSchoenflies notation
Density1.1136 @ 20°C
Boiling Point69.3 °C @760 [mm Hg]
Melting Point-33.9 °C
Physical DescriptionClear colorless liquid; [MSDSonline]
Physicochemical properties
- Melting point
- -35 °C · -35 °C (lit.)
- Boiling point
- 68 · 68-69 °C (lit.)
- Density
- 1.082 g/mL · 1.082 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.4145(lit.)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 8.3% (1 of 12) of reports.
Danger
H225 (91.7%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P271, P280, P303+P361+P353, P304+P340, P317, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 12 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationChemical: Propane, 2,2-dichloro-
Hazards SummaryAn eye irritant; [MSDSonline] See 1,1-Dichloropropane and 1,3-Dichloropropane.
Hazard Classes and CategoriesFlam. Liq. 2 (91.7%)
Safety & protection
Protective Action Criteria (PAC)
2.6 [ppm]
29 [ppm]
170 [ppm]
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Toxicity DataLC (rat) > 3,500 ppm/6h
USGS Health-Based Screening Levels for Evaluating Water-Quality
Chemistry & industry
Uses & manufacturing
UsesUsed to make an isomerization catalyst and to isomerize saturated hydrocarbons; [NTP]
General Manufacturing InformationPropane, 2,2-dichloro-: ACTIVE
Applications
Uses2,2-Dichloropropane can be used to determine the occurrence and distribution of volatile organic compounds in conventional and advanced drinking water treatment processes.
General DescriptionDehydrohalogenation of 2,2-dichloropropane sorbed in micropores of several model mineral solids has been investigated. Polymorphism of 2,2-dichloropropane has been investigated by thermal and X-ray powder diffraction experiments.
Upstream & downstream products
Downstream products
Suppliers73 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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