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128780-26-7 | Bicyclo[2.2.1]hepta-2,5-diene, 2-bromo-3-chloro-
CAS No: 128780-26-7 Catalog No: AG000YDQ MDL No:
Product Description
Catalog Number:
AG000YDQ
Chemical Name:
Bicyclo[2.2.1]hepta-2,5-diene, 2-bromo-3-chloro-
CAS Number:
128780-26-7
Molecular Formula:
C7H6BrCl
Molecular Weight:
205.4795
IUPAC Name:
2-bromo-3-chlorobicyclo[2.2.1]hepta-2,5-diene
InChI:
InChI=1S/C7H6BrCl/c8-6-4-1-2-5(3-4)7(6)9/h1-2,4-5H,3H2
InChI Key:
LQJYBSLPWXFMCQ-UHFFFAOYSA-N
SMILES:
ClC1=C(Br)C2CC1C=C2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.934g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.479g/mol
Monoisotopic Mass:
203.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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