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15729-81-4

15729-81-4 | 1-Coronenecarboxaldehyde, hydrazone

CAS No: 15729-81-4 Catalog No: AG001PD2 MDL No:

Product Description

Catalog Number:
AG001PD2
Chemical Name:
1-Coronenecarboxaldehyde, hydrazone
CAS Number:
15729-81-4
Molecular Formula:
C25H14N2
Molecular Weight:
342.3921
IUPAC Name:
coronen-1-ylmethylidenehydrazine
InChI:
InChI=1S/C25H14N2/c26-27-12-18-11-17-8-7-15-4-2-13-1-3-14-5-6-16-9-10-19(18)25-23(16)21(14)20(13)22(15)24(17)25/h1-12H,26H2
InChI Key:
HIIWCJOZAXJYBJ-UHFFFAOYSA-N
SMILES:
NN=Cc1cc2ccc3c4c2c2c1ccc1c2c2c4c(cc3)ccc2cc1

Properties

Complexity:
642  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.116g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
342.401g/mol
Monoisotopic Mass:
342.116g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
38.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
6.9  

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