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72602-64-3

72602-64-3 | Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxaldehyde

CAS No: 72602-64-3 Catalog No: AG005QKP MDL No:

Product Description

Catalog Number:
AG005QKP
Chemical Name:
Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxaldehyde
CAS Number:
72602-64-3
Molecular Formula:
C9H8O2
Molecular Weight:
148.1586
IUPAC Name:
bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarbaldehyde
InChI:
InChI=1S/C9H8O2/c10-4-8-6-1-2-7(3-6)9(8)5-11/h1-2,4-7H,3H2
InChI Key:
RGKMJRDMXSNTGR-UHFFFAOYSA-N
SMILES:
O=CC1=C(C=O)C2CC1C=C2

Properties

Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.052g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.161g/mol
Monoisotopic Mass:
148.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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