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19047-28-0

19047-28-0 | Indeno[6,7,1-cde]indol-2(1H)-one, 5,6-dihydro-

CAS No: 19047-28-0 Catalog No: AG002ELW MDL No:

Product Description

Catalog Number:
AG002ELW
Chemical Name:
Indeno[6,7,1-cde]indol-2(1H)-one, 5,6-dihydro-
CAS Number:
19047-28-0
Molecular Formula:
C13H9NO
Molecular Weight:
195.2167
IUPAC Name:
2-azatetracyclo[5.5.2.04,13.010,14]tetradeca-1(12),4(13),5,7(14),10-pentaen-3-one
InChI:
InChI=1S/C13H9NO/c15-13-9-5-3-7-1-2-8-4-6-10(14-13)12(9)11(7)8/h3-6H,1-2H2,(H,14,15)
InChI Key:
UPOALHXKOJUIFT-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c3c1ccc1c3c(cc2)CC1
NSC Number:
105272

Properties

Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.068g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.221g/mol
Monoisotopic Mass:
195.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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