Home Aldehydes 3H,4H,6H,7H-pyrano[3,4-d]imidazole-2-carbaldehyde

3H,4H,6H,7H-pyrano[3,4-d]imidazole-2-carbaldehyde

CAS No.:
1341086-36-9
Catalog Number:
AG01DVAF
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
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Product Description
Catalog Number:
AG01DVAF
Chemical Name:
3H,4H,6H,7H-pyrano[3,4-d]imidazole-2-carbaldehyde
CAS Number:
1341086-36-9
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD19608924
IUPAC Name:
3,4,6,7-tetrahydropyrano[3,4-d]imidazole-2-carbaldehyde
InChI:
InChI=1S/C7H8N2O2/c10-3-7-8-5-1-2-11-4-6(5)9-7/h3H,1-2,4H2,(H,8,9)
InChI Key:
SRHIZJRBWFRMCO-UHFFFAOYSA-N
SMILES:
O=Cc1nc2c([nH]1)COCC2
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties