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1324-02-3 | Dibenzo[def,mno]chrysene-6,12-dione, dichloro-
CAS No: 1324-02-3 Catalog No: AG0010NN MDL No:
Product Description
Catalog Number:
AG0010NN
Chemical Name:
Dibenzo[def,mno]chrysene-6,12-dione, dichloro-
CAS Number:
1324-02-3
Molecular Formula:
C22H8Cl2O2
Molecular Weight:
375.2037
IUPAC Name:
5,6-dichlorohexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1(20),2(11),3,5,7,9,13,15,17(21),18-decaene-12,22-dione
InChI:
InChI=1S/C22H8Cl2O2/c23-14-8-10-5-7-12-18-16(10)19(20(14)24)22(26)13-6-4-9-2-1-3-11(21(12)25)15(9)17(13)18/h1-8H
InChI Key:
LCTLMIPZSQBZAG-UHFFFAOYSA-N
SMILES:
Clc1c(Cl)cc2c3c1c(=O)c1ccc4c5c1c3c(cc2)c(=O)c5ccc4
EC Number:
215-361-1
Properties
Complexity:
663
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.99g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.204g/mol
Monoisotopic Mass:
373.99g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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