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2-Chloropropene

CAS No.:
557-98-2
Catalog Number:
AG003H3D
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003H3D
Chemical Name:
2-Chloropropene
CAS Number:
557-98-2
MDL Number:
MFCD00000859
IUPAC Name:
2-chloroprop-1-ene
InChI:
InChI=1S/C3H5Cl/c1-3(2)4/h1H2,2H3
InChI Key:
PNLQPWWBHXMFCA-UHFFFAOYSA-N
EC Number:
209-187-5
UNII:
50TXN55E4A
UN Number:
2456
Properties
Complexity:
30.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
76.008g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
76.523g/mol
Monoisotopic Mass:
76.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Structure-activity relationship (SAR) for the prediction of gas-phase ozonolysis rate coefficients: an extension towards heteroatomic unsaturated species. Physical chemistry chemical physics : PCCP 20110221
Internal energy of HCl upon photolysis of 2-chloropropene at 193 nm investigated with time-resolved Fourier-transform spectroscopy and quasiclassical trajectories. The Journal of chemical physics 20081214
Sorption and inhibited dehydrohalogenation of 2,2-dichloropropane in micropores of dealuminated Y zeolites. Environmental science & technology 20070315
Kinetics of the unimolecular decomposition of the 2-chloroallyl radical. The journal of physical chemistry. A 20050915
One-photon mass-analyzed threshold ionization spectroscopy of 2-chloropropene (2-C3H5Cl) and its vibrational assignment based on the density-functional theory calculations. The Journal of chemical physics 20050722
Tetrachloroethene reductive dehalogenase of Dehalospirillum multivorans: substrate specificity of the native enzyme and its corrinoid cofactor. Archives of microbiology 20020501
Properties