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13320-56-4 | Pentane, 1,1-dibromo-
CAS No: 13320-56-4 Catalog No: AG0014ER MDL No:
Product Description
Catalog Number:
AG0014ER
Chemical Name:
Pentane, 1,1-dibromo-
CAS Number:
13320-56-4
Molecular Formula:
C5H10Br2
Molecular Weight:
229.9409
IUPAC Name:
1,1-dibromopentane
InChI:
InChI=1S/C5H10Br2/c1-2-3-4-5(6)7/h5H,2-4H2,1H3
InChI Key:
QBLPUSMNBSNAHZ-UHFFFAOYSA-N
SMILES:
CCCCC(Br)Br
Properties
Complexity:
35.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.913g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.943g/mol
Monoisotopic Mass:
227.915g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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