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1809-10-5 | Pentane, 3-bromo-
CAS No: 1809-10-5 Catalog No: AG0022GF MDL No:MFCD00000158
Product Description
Catalog Number:
AG0022GF
Chemical Name:
Pentane, 3-bromo-
CAS Number:
1809-10-5
Molecular Formula:
C5H11Br
Molecular Weight:
151.0448
MDL Number:
MFCD00000158
IUPAC Name:
3-bromopentane
InChI:
InChI=1S/C5H11Br/c1-3-5(6)4-2/h5H,3-4H2,1-2H3
InChI Key:
VTOQFOCYBTVOJZ-UHFFFAOYSA-N
SMILES:
CCC(CC)Br
EC Number:
217-314-0
Properties
Complexity:
23.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.004g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.047g/mol
Monoisotopic Mass:
150.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Literature
| Title | Journal |
|---|---|
| Dynamics of glass-forming liquids. X. Dielectric relaxation of 3-bromopentane as molecular probes in 3-methylpentane. | The Journal of chemical physics 20051022 |
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