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4549-32-0 | 1,8-Dibromooctane
CAS No: 4549-32-0 Catalog No: AG0032NJ MDL No:MFCD00000277
Product Description
Catalog Number:
AG0032NJ
Chemical Name:
1,8-Dibromooctane
CAS Number:
4549-32-0
Molecular Formula:
C8H16Br2
Molecular Weight:
272.0206
MDL Number:
MFCD00000277
IUPAC Name:
1,8-dibromooctane
InChI:
InChI=1S/C8H16Br2/c9-7-5-3-1-2-4-6-8-10/h1-8H2
InChI Key:
DKEGCUDAFWNSSO-UHFFFAOYSA-N
SMILES:
BrCCCCCCCCBr
EC Number:
224-912-5
NSC Number:
9820
Properties
Complexity:
47.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.96g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.024g/mol
Monoisotopic Mass:
269.962g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
Literature
| Title | Journal |
|---|---|
| Polyamine aza-cyclic compounds demonstrate anti-proliferative activity in vitro but fail to control tumour growth in vivo. | Journal of pharmaceutical sciences 20101101 |
| Selective and irreversible inhibitors of aphid acetylcholinesterases: steps toward human-safe insecticides. | PloS one 20090101 |
| Octane-1,8-diyldipyridinium dibromide dihydrate. | Acta crystallographica. Section E, Structure reports online 20080101 |
| Kinetics of molecular transport in a nanoporous crystal studied by confocal Raman microspectrometry: single-file diffusion in a densely filled tunnel. | The journal of physical chemistry. B 20071101 |
| Vapour pressures, aqueous solubility, Henry's law constants and air/water partition coefficients of 1,8-dichlorooctane and 1,8-dibromooctane. | Chemosphere 20060901 |
| Significant conformational changes associated with molecular transport in a crystalline solid. | The journal of physical chemistry. B 20060608 |
| The synthesis of carboacycles derived from B,B'-bis(aryl) derivatives of icosahedral ortho-carborane. | Chemistry (Weinheim an der Bergstrasse, Germany) 20030616 |
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