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Home > Aldehydes > 876890-38-9
876890-38-9 | 2-Propylpyrimidine-5-carbaldehyde
CAS No: 876890-38-9 Catalog No: AG004GXI MDL No:MFCD07186435
Product Description
Catalog Number:
AG004GXI
Chemical Name:
2-Propylpyrimidine-5-carbaldehyde
CAS Number:
876890-38-9
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
MDL Number:
MFCD07186435
IUPAC Name:
2-propylpyrimidine-5-carbaldehyde
InChI:
InChI=1S/C8H10N2O/c1-2-3-8-9-4-7(6-11)5-10-8/h4-6H,2-3H2,1H3
InChI Key:
GLQPRYHEYJHVJX-UHFFFAOYSA-N
SMILES:
CCCc1ncc(cn1)C=O
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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