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Home > Aldehydes > 1860780-89-7
1860780-89-7 | 2-{3-azabicyclo[3.1.0]hexan-3-yl}pyrimidine-5-carbaldehyde
CAS No: 1860780-89-7 Catalog No: AG01C8VP MDL No:MFCD30191190
Product Description
Catalog Number:
AG01C8VP
Chemical Name:
2-{3-azabicyclo[3.1.0]hexan-3-yl}pyrimidine-5-carbaldehyde
CAS Number:
1860780-89-7
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD30191190
IUPAC Name:
2-(3-azabicyclo[3.1.0]hexan-3-yl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C10H11N3O/c14-6-7-2-11-10(12-3-7)13-4-8-1-9(8)5-13/h2-3,6,8-9H,1,4-5H2
InChI Key:
MQXSQMKAFFFCBW-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)N1CC2C(C1)C2
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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