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90905-56-9 | 2,4,6-trimethylpyrimidine-5-carbaldehyde
CAS No: 90905-56-9 Catalog No: AG01AC1M MDL No:MFCD18821990
Product Description
Catalog Number:
AG01AC1M
Chemical Name:
2,4,6-trimethylpyrimidine-5-carbaldehyde
CAS Number:
90905-56-9
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
MDL Number:
MFCD18821990
IUPAC Name:
2,4,6-trimethylpyrimidine-5-carbaldehyde
InChI:
InChI=1S/C8H10N2O/c1-5-8(4-11)6(2)10-7(3)9-5/h4H,1-3H3
InChI Key:
WQZSTMJTSRAEOL-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)nc(nc1C)C
Properties
Complexity:
137
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:
1
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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