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169051-20-1

169051-20-1 | 9-(2-Ethylhexyl)carbazole-3,6-dicarboxaldehyde

CAS No: 169051-20-1 Catalog No: AG003NJ3 MDL No:

Product Description

Catalog Number:
AG003NJ3
Chemical Name:
9-(2-Ethylhexyl)carbazole-3,6-dicarboxaldehyde
CAS Number:
169051-20-1
Molecular Formula:
C22H25NO2
Molecular Weight:
335.4394
IUPAC Name:
9-(2-ethylhexyl)carbazole-3,6-dicarbaldehyde
InChI:
InChI=1S/C22H25NO2/c1-3-5-6-16(4-2)13-23-21-9-7-17(14-24)11-19(21)20-12-18(15-25)8-10-22(20)23/h7-12,14-16H,3-6,13H2,1-2H3
InChI Key:
JWQOZEXSBKOAAL-UHFFFAOYSA-N
SMILES:
CCCCC(Cn1c2ccc(cc2c2c1ccc(c2)C=O)C=O)CC

Properties

Complexity:
419  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.189g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.447g/mol
Monoisotopic Mass:
335.189g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  

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