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6940-78-9 | 1-Bromo-4-chlorobutane
CAS No: 6940-78-9 Catalog No: AG0032PU MDL No:MFCD00001010
Product Description
Catalog Number:
AG0032PU
Chemical Name:
1-Bromo-4-chlorobutane
CAS Number:
6940-78-9
Molecular Formula:
C4H8BrCl
Molecular Weight:
171.4633
MDL Number:
MFCD00001010
IUPAC Name:
1-bromo-4-chlorobutane
InChI:
InChI=1S/C4H8BrCl/c5-3-1-2-4-6/h1-4H2
InChI Key:
NIDSRGCVYOEDFW-UHFFFAOYSA-N
SMILES:
ClCCCCBr
EC Number:
230-089-3
NSC Number:
60193
Properties
Complexity:
23.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.95g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.462g/mol
Monoisotopic Mass:
169.95g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Synthesis of New 6-{[ω-(Dialkylamino(heterocyclyl)alkyl]thio}-3-R-2H-[1,2,4]triazino[2,3-c]quinazoline-2-ones and Evaluation of their Anticancer and Antimicrobial Activities. | Scientia pharmaceutica 20120101 |
| 1-[4-(3-{[5-(4-Chloro-phen-yl)furan-2-yl]methyl-idene-amino}-2,5-dioxoimidazol-idin-1-yl)but-yl]-4-methyl-piperazine-1,4-diium dichloride hemihydrate. | Acta crystallographica. Section E, Structure reports online 20110201 |
| 1-[4-(4-Chloro-but-oxy)-2-hy-droxy-phen-yl]ethanone. | Acta crystallographica. Section E, Structure reports online 20110201 |
| Synthesis and chemical characterization of 2-methoxy-N(10)-substituted acridones needed to reverse vinblastine resistance in multidrug resistant (MDR) cancer cells. | Bioorganic & medicinal chemistry 20020701 |
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