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Home > Aldehydes > 1853058-58-8
1853058-58-8 | 2-{2-oxa-5-azabicyclo[2.2.1]heptan-5-yl}pyrimidine-5-carbaldehyde
CAS No: 1853058-58-8 Catalog No: AG01C8WC MDL No:MFCD31443346
Product Description
Catalog Number:
AG01C8WC
Chemical Name:
2-{2-oxa-5-azabicyclo[2.2.1]heptan-5-yl}pyrimidine-5-carbaldehyde
CAS Number:
1853058-58-8
Molecular Formula:
C10H11N3O2
Molecular Weight:
205.2132
MDL Number:
MFCD31443346
IUPAC Name:
2-(2-oxa-5-azabicyclo[2.2.1]heptan-5-yl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C10H11N3O2/c14-5-7-2-11-10(12-3-7)13-4-9-1-8(13)6-15-9/h2-3,5,8-9H,1,4,6H2
InChI Key:
HSQACWJXFSEPNW-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)N1CC2CC1CO2
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.217g/mol
Monoisotopic Mass:
205.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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