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1190-22-3 | Butane, 1,3-dichloro-
CAS No: 1190-22-3 Catalog No: AG000P0K MDL No:MFCD00000870
Product Description
Catalog Number:
AG000P0K
Chemical Name:
Butane, 1,3-dichloro-
CAS Number:
1190-22-3
Molecular Formula:
C4H8Cl2
Molecular Weight:
127.0123
MDL Number:
MFCD00000870
IUPAC Name:
1,3-dichlorobutane
InChI:
InChI=1S/C4H8Cl2/c1-4(6)2-3-5/h4H,2-3H2,1H3
InChI Key:
QBGVARBIQGHVKR-UHFFFAOYSA-N
SMILES:
ClCCC(Cl)C
EC Number:
214-718-9
Properties
Complexity:
28.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.008g/mol
Monoisotopic Mass:
126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Elucidation of the enantioselective enzymatic hydrolysis of chiral herbicide dichlorprop methyl by chemical modification. | Journal of agricultural and food chemistry 20110309 |
| Characterization of racemization of chiral pesticides in organic solvents and water. | Journal of chromatography. A 20100903 |
| Enantioselective separation and degradation of the herbicide dichlorprop methyl in sediment. | Chirality 20090401 |
| Enantioselectivity in toxicity and degradation of dichlorprop-methyl in algal cultures. | Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20080501 |
| Influence of kaolinite on chiral hydrolysis of methyl dichlorprop enantiomers. | Journal of Zhejiang University. Science. B 20051001 |
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