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1872824-80-0 | 4-(2-methylpyrimidin-4-yl)thiomorpholine
CAS No: 1872824-80-0 Catalog No: AG01FMEU MDL No:MFCD29935242
Product Description
Catalog Number:
AG01FMEU
Chemical Name:
4-(2-methylpyrimidin-4-yl)thiomorpholine
CAS Number:
1872824-80-0
Molecular Formula:
C9H13N3S
Molecular Weight:
195.2846
MDL Number:
MFCD29935242
IUPAC Name:
4-(2-methylpyrimidin-4-yl)thiomorpholine
InChI:
InChI=1S/C9H13N3S/c1-8-10-3-2-9(11-8)12-4-6-13-7-5-12/h2-3H,4-7H2,1H3
InChI Key:
MKVLGCXRFSFMDL-UHFFFAOYSA-N
SMILES:
Cc1nccc(n1)N1CCSCC1
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.083g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.284g/mol
Monoisotopic Mass:
195.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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