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13866-30-3 | Bicyclo[6.2.0]dec-4-en-9-one, 10,10-dichloro-
CAS No: 13866-30-3 Catalog No: AG0018Z9 MDL No:
Product Description
Catalog Number:
AG0018Z9
Chemical Name:
Bicyclo[6.2.0]dec-4-en-9-one, 10,10-dichloro-
CAS Number:
13866-30-3
Molecular Formula:
C10H12Cl2O
Molecular Weight:
219.1077
IUPAC Name:
10,10-dichlorobicyclo[6.2.0]dec-4-en-9-one
InChI:
InChI=1S/C10H12Cl2O/c11-10(12)8-6-4-2-1-3-5-7(8)9(10)13/h1-2,7-8H,3-6H2
InChI Key:
ZTLPNWVVJSCCPN-UHFFFAOYSA-N
SMILES:
O=C1C2CCC=CCCC2C1(Cl)Cl
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.027g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.105g/mol
Monoisotopic Mass:
218.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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