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Home > Aldehydes > 1881638-00-1
1881638-00-1 | 2-(azetidin-1-yl)pyrimidine-5-carbaldehyde
CAS No: 1881638-00-1 Catalog No: AG01C8Q1 MDL No:MFCD31443204
Product Description
Catalog Number:
AG01C8Q1
Chemical Name:
2-(azetidin-1-yl)pyrimidine-5-carbaldehyde
CAS Number:
1881638-00-1
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
MDL Number:
MFCD31443204
IUPAC Name:
2-(azetidin-1-yl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C8H9N3O/c12-6-7-4-9-8(10-5-7)11-2-1-3-11/h4-6H,1-3H2
InChI Key:
FXDVUNKIEHNQJF-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)N1CCC1
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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