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626-87-9 | 1,4-Dibromopentane
CAS No: 626-87-9 Catalog No: AG003DO0 MDL No:MFCD00000153
Product Description
Catalog Number:
AG003DO0
Chemical Name:
1,4-Dibromopentane
CAS Number:
626-87-9
Molecular Formula:
C5H10Br2
Molecular Weight:
229.9409
MDL Number:
MFCD00000153
IUPAC Name:
1,4-dibromopentane
InChI:
InChI=1S/C5H10Br2/c1-5(7)3-2-4-6/h5H,2-4H2,1H3
InChI Key:
CNBFRBXEGGRSPL-UHFFFAOYSA-N
SMILES:
BrCCCC(Br)C
EC Number:
210-967-2
NSC Number:
8753
Properties
Complexity:
37.1
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:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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