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107-06-2 molecular structure
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1,2-dichloroethane

ChemBase ID: 3385
Molecular Formular: C2H4Cl2
Molecular Mass: 98.95916
Monoisotopic Mass: 97.96900549
SMILES and InChIs

SMILES:
ClCCCl
Canonical SMILES:
ClCCCl
InChI:
InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2
InChIKey:
WSLDOOZREJYCGB-UHFFFAOYSA-N

Cite this record

CBID:3385 http://www.chembase.cn/molecule-3385.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1,2-dichloroethane
IUPAC Traditional name
ethylene dichloride
Synonyms
Ethylene Dichloride
Ethane dichloride
Dutch liquid, Dutch oil
Freon 150
1,2-Dichloroethane
1,2-Dichloroethane, Spectrophotometric Grade
1,2-Dichloroethane, HPLC Grade
1,2-Dichloroethane, ACS
Ethylene dichloride
1,2-DICHLOROETHANE
Dichloro-1,2-Ethane
Bichlorure d'ethylene
Dutch Oil
1,2-DICHLOROETHANE ACS REAGENT GRADE
1,2-DICHLOROETHANE, ANHYDROSOLV GRADE
1,2-DICHLOROETHANE, HPLC/SPECTRO GRADE
Ethylene chloride
EDC
二氯化乙烯
氯化乙烯
1,2-二氯乙烷
1,2-二氯乙烷, 光谱级
1,2-二氯乙烷, HPLC级
1,2-二氯乙烷,ACS
CAS Number
107-06-2
EC Number
203-458-1
MDL Number
MFCD00000963
Beilstein Number
605264
Merck Index
143797
PubChem SID
24845319
24849474
24857161
24859199
24872022
24894007
24845496
24856381
160966826
24845497
46504791
24845498
PubChem CID
11
CHEMBL
16370
Chemspider ID
10
KEGG ID
C06752
Unique Ingredient Identifier
55163IJI47
Wikipedia Title
1,2-Dichloroethane

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem ALOGPS 2.1
H Acceptors H Donor
LogD (pH = 5.5) 1.5005046  LogD (pH = 7.4) 1.5005046 
Log P 1.5005046  Molar Refractivity 20.6556 cm3
Polarizability 8.169801 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 
Log P 1.48  LOG S -1.22 
Solubility (Water) 5.94e+00 g/l 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
0.87 g/100 mL (20 °C) in water expand Show data source
Apperance
APHA: ≤10 expand Show data source
clear expand Show data source
Colorless liquid with
characteristic odor
expand Show data source
Liquid expand Show data source
Melting Point
-35 °C(lit.) expand Show data source
-35°C expand Show data source
-35°C expand Show data source
-36 °C expand Show data source
-36°C expand Show data source
Boiling Point
82.5-84.5 °C(lit.) expand Show data source
83 °C expand Show data source
83 °C(lit.) expand Show data source
83.5 °C at 1013 hPa expand Show data source
83.5°C expand Show data source
83°C expand Show data source
84°C expand Show data source
Flash Point
13 °C (closed cup) expand Show data source
13 °C expand Show data source
15°C(59°F) expand Show data source
55 °F expand Show data source
55.4 °F expand Show data source
Auto Ignition Point
413 °C at 1013 hPa expand Show data source
775 °F expand Show data source
Density
1.25 g/cm3 at 20 °C expand Show data source
1.25 g/ml expand Show data source
1.253 g/cm3, liquid expand Show data source
1.256 expand Show data source
1.256 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4448 expand Show data source
n20/D 1.444 expand Show data source
n20/D 1.444(lit.) expand Show data source
n20/D 1.445 expand Show data source
Vapor Pressure
86 hPa at 20 °C expand Show data source
87 mmHg ( 25 °C) expand Show data source
Vapor Density
3.4 (20 °C, vs air) expand Show data source
3.4 (air = 1) expand Show data source
Absorption Wavelength
λ: 230 nm Amax: 0.5 expand Show data source
λ: 230 nm Amax: 1.0 expand Show data source