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188-01-2 | Benzo[a]phenanthro[1,10,9-jkl]acridine (8CI,9CI)
CAS No: 188-01-2 Catalog No: AG002GN1 MDL No:
Product Description
Catalog Number:
AG002GN1
Chemical Name:
Benzo[a]phenanthro[1,10,9-jkl]acridine (8CI,9CI)
CAS Number:
188-01-2
Molecular Formula:
C27H15N
Molecular Weight:
353.4147
IUPAC Name:
12-azaheptacyclo[14.10.2.02,11.03,8.013,27.020,28.021,26]octacosa-1(27),2(11),3,5,7,9,12,14,16(28),17,19,21,23,25-tetradecaene
InChI:
InChI=1S/C27H15N/c1-2-8-18-16(6-1)12-14-22-25(18)26-21-10-4-3-9-19(21)20-11-5-7-17-13-15-23(28-22)27(26)24(17)20/h1-15H
InChI Key:
SBEAINFARUUDLW-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)ccc1c2c2c3ccccc3c3c4c2c(n1)ccc4ccc3
Properties
Complexity:
599
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.12g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.424g/mol
Monoisotopic Mass:
353.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9
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