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13152-83-5 | 1(2H)-Acenaphthylenone, 2-(chloromethylene)-
CAS No: 13152-83-5 Catalog No: AG000ZC5 MDL No:
Product Description
Catalog Number:
AG000ZC5
Chemical Name:
1(2H)-Acenaphthylenone, 2-(chloromethylene)-
CAS Number:
13152-83-5
Molecular Formula:
C13H7ClO
Molecular Weight:
214.6471
IUPAC Name:
2-(chloromethylidene)acenaphthylen-1-one
InChI:
InChI=1S/C13H7ClO/c14-7-11-9-5-1-3-8-4-2-6-10(12(8)9)13(11)15/h1-7H
InChI Key:
RPFYLZKMBJGMLR-UHFFFAOYSA-N
SMILES:
ClC=c1c2cccc3c2c(c1=O)ccc3
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.019g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.648g/mol
Monoisotopic Mass:
214.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.5
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