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16644-66-9 | Pentane, 1,1,1-tribromo-
CAS No: 16644-66-9 Catalog No: AG001WRC MDL No:
Product Description
Catalog Number:
AG001WRC
Chemical Name:
Pentane, 1,1,1-tribromo-
CAS Number:
16644-66-9
Molecular Formula:
C5H9Br3
Molecular Weight:
308.8370
IUPAC Name:
1,1,1-tribromopentane
InChI:
InChI=1S/C5H9Br3/c1-2-3-4-5(6,7)8/h2-4H2,1H3
InChI Key:
OLGZGTYKTDDDFV-UHFFFAOYSA-N
SMILES:
CCCCC(Br)(Br)Br
Properties
Complexity:
55.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.823g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.839g/mol
Monoisotopic Mass:
305.825g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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