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Home > Nitro Compounds > 883054-85-1
883054-85-1 | 2-(METHYLTHIO)-4-(3-NITROPHENYL)PYRIMIDINE
CAS No: 883054-85-1 Catalog No: AG01DLFO MDL No:
Product Description
Catalog Number:
AG01DLFO
Chemical Name:
2-(METHYLTHIO)-4-(3-NITROPHENYL)PYRIMIDINE
CAS Number:
883054-85-1
IUPAC Name:
2-methylsulfanyl-4-(3-nitrophenyl)pyrimidine
InChI:
InChI=1S/C11H9N3O2S/c1-17-11-12-6-5-10(13-11)8-3-2-4-9(7-8)14(15)16/h2-7H,1H3
InChI Key:
SVVRBLCEJHYTLX-UHFFFAOYSA-N
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.042g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.272g/mol
Monoisotopic Mass:
247.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
96.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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