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97517-24-3 | 6,6-DICHLORO-7-OXOBICYCLO[3.2.0]HEPT-2-ENE-2-CARBALDEHYDE
CAS No: 97517-24-3 Catalog No: AG006BS2 MDL No:
Product Description
Catalog Number:
AG006BS2
Chemical Name:
6,6-DICHLORO-7-OXOBICYCLO[3.2.0]HEPT-2-ENE-2-CARBALDEHYDE
CAS Number:
97517-24-3
Molecular Formula:
C8H6Cl2O2
Molecular Weight:
205.0380
IUPAC Name:
6,6-dichloro-7-oxobicyclo[3.2.0]hept-2-ene-2-carbaldehyde
InChI:
InChI=1S/C8H6Cl2O2/c9-8(10)5-2-1-4(3-11)6(5)7(8)12/h1,3,5-6H,2H2
InChI Key:
YZJKHTJBJSZVEW-UHFFFAOYSA-N
SMILES:
O=CC1=CCC2C1C(=O)C2(Cl)Cl
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.974g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.034g/mol
Monoisotopic Mass:
203.974g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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