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Home > Aldehydes > 832110-91-5
832110-91-5 | 7-Oxabicyclo[4.1.0]hepta-2,4-diene-1,6-dicarboxaldehyde
CAS No: 832110-91-5 Catalog No: AG004UXP MDL No:
Product Description
Catalog Number:
AG004UXP
Chemical Name:
7-Oxabicyclo[4.1.0]hepta-2,4-diene-1,6-dicarboxaldehyde
CAS Number:
832110-91-5
Molecular Formula:
C8H6O3
Molecular Weight:
150.1314
IUPAC Name:
7-oxabicyclo[4.1.0]hepta-2,4-diene-1,6-dicarbaldehyde
InChI:
InChI=1S/C8H6O3/c9-5-7-3-1-2-4-8(7,6-10)11-7/h1-6H
InChI Key:
ODMBGTWOAXWJJT-UHFFFAOYSA-N
SMILES:
O=CC12C=CC=CC2(O1)C=O
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.032g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.133g/mol
Monoisotopic Mass:
150.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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