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94053-43-7

94053-43-7 | 4-Azulenecarboxaldehyde

CAS No: 94053-43-7 Catalog No: AG005VR6 MDL No:

Product Description

Catalog Number:
AG005VR6
Chemical Name:
4-Azulenecarboxaldehyde
CAS Number:
94053-43-7
Molecular Formula:
C11H8O
Molecular Weight:
156.1806
IUPAC Name:
azulene-4-carbaldehyde
InChI:
InChI=1S/C11H8O/c12-8-10-5-2-1-4-9-6-3-7-11(9)10/h1-8H
InChI Key:
CTGDIWHSILYUNQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc2c1ccc2

Properties

Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.184g/mol
Monoisotopic Mass:
156.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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