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2-Chloropropane

CAS No.:
75-29-6
Catalog Number:
AG003H3C
Molecular Formula:
C3H7Cl
Molecular Weight:
78.5407
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Product Description
Catalog Number:
AG003H3C
Chemical Name:
2-Chloropropane
CAS Number:
75-29-6
Molecular Formula:
C3H7Cl
Molecular Weight:
78.5407
MDL Number:
MFCD00000867
IUPAC Name:
2-chloropropane
InChI:
InChI=1S/C3H7Cl/c1-3(2)4/h3H,1-2H3
InChI Key:
ULYZAYCEDJDHCC-UHFFFAOYSA-N
SMILES:
CC(Cl)C
EC Number:
200-858-8
UNII:
VU39J8AJ2N
UN Number:
2356
Properties
Complexity:
10.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
78.024g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
78.539g/mol
Monoisotopic Mass:
78.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Differential mobility spectrometry of isomeric protonated dipeptides: modifier and field effects on ion mobility and stability. Analytical chemistry 20110501
Design, synthesis and characterization of a highly effective inhibitor for analog-sensitive (as) kinases. PloS one 20110101
Dissociation dynamics of energy selected, propane, and i-C(3)H(7)X(+) Ions by iPEPICO: accurate heats of formation of i-C(3)H(7)(+), i-C(3)H(7)Cl, i-C(3)H(7)Br, and i-C(3)H(7)I. The journal of physical chemistry. A 20101028
Redesigning dehalogenase access tunnels as a strategy for degrading an anthropogenic substrate. Nature chemical biology 20091001
Reactions of alpha-nucleophiles with alkyl chlorides: competition between S(N)2 and E2 mechanisms and the gas-phase alpha-effect. Journal of the American Chemical Society 20090617
Grunwald-Winstein analysis: isopropyl chloroformate solvolysis revisited. International journal of molecular sciences 20090301
Tunneling in the loss of hydrogen chloride from isopropyl chloride cation. The journal of physical chemistry. A 20060420
(6,17-Dimethyl-8,15-diphenyldibenzo[b,i][1,4,8,11]-tetra-aza[14]annulenato)nickel(II) in solids: two guest-free polymorphs and inclusion compounds with methylene chloride and fullerene (C(60))-carbon disulfide. Inorganic chemistry 20011022
Equilibria between alpha- and beta-agostic stabilized rotamers of secondary alkyl niobium complexes. Journal of the American Chemical Society 20010627
Properties