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13152-85-7 | 1(2H)-Acenaphthylenone, 2,2-dichloro-
CAS No: 13152-85-7 Catalog No: AG000ZC3 MDL No:
Product Description
Catalog Number:
AG000ZC3
Chemical Name:
1(2H)-Acenaphthylenone, 2,2-dichloro-
CAS Number:
13152-85-7
Molecular Formula:
C12H6Cl2O
Molecular Weight:
237.0814
IUPAC Name:
2,2-dichloroacenaphthylen-1-one
InChI:
InChI=1S/C12H6Cl2O/c13-12(14)9-6-2-4-7-3-1-5-8(10(7)9)11(12)15/h1-6H
InChI Key:
MAUALHPVHNLDNX-UHFFFAOYSA-N
SMILES:
O=C1c2cccc3c2c(C1(Cl)Cl)ccc3
NSC Number:
127037
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.98g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.079g/mol
Monoisotopic Mass:
235.98g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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