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Home > Aldehydes > 1601930-93-1
1601930-93-1 | 2-(2-methylthiomorpholin-4-yl)pyrimidine-5-carbaldehyde
CAS No: 1601930-93-1 Catalog No: AG01C8RW MDL No:MFCD31443222
Product Description
Catalog Number:
AG01C8RW
Chemical Name:
2-(2-methylthiomorpholin-4-yl)pyrimidine-5-carbaldehyde
CAS Number:
1601930-93-1
Molecular Formula:
C10H13N3OS
Molecular Weight:
223.2947
MDL Number:
MFCD31443222
IUPAC Name:
2-(2-methylthiomorpholin-4-yl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C10H13N3OS/c1-8-6-13(2-3-15-8)10-11-4-9(7-14)5-12-10/h4-5,7-8H,2-3,6H2,1H3
InChI Key:
MXCZQTCBJFXMEV-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1)N1CCSC(C1)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.078g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.294g/mol
Monoisotopic Mass:
223.078g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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