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178877-39-9 | 2-Butene, 1-bromo-2-iodo-, (2E)-
CAS No: 178877-39-9 Catalog No: AG0026FX MDL No:
Product Description
Catalog Number:
AG0026FX
Chemical Name:
2-Butene, 1-bromo-2-iodo-, (2E)-
CAS Number:
178877-39-9
Molecular Formula:
C4H6BrI
Molecular Weight:
260.8989
IUPAC Name:
1-bromo-2-iodobut-2-ene
InChI:
InChI=1S/C4H6BrI/c1-2-4(6)3-5/h2H,3H2,1H3
InChI Key:
BWGFXGKYRIWCCL-UHFFFAOYSA-N
SMILES:
C/C=C(\CBr)/I
Properties
Complexity:
58.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.87g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.9g/mol
Monoisotopic Mass:
259.87g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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