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54070-76-7 | 1-methyl-3-(3-methylpyridin-2-yl)urea
CAS No: 54070-76-7 Catalog No: AG01DWHI MDL No:MFCD08722318
Product Description
Catalog Number:
AG01DWHI
Chemical Name:
1-methyl-3-(3-methylpyridin-2-yl)urea
CAS Number:
54070-76-7
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
MDL Number:
MFCD08722318
IUPAC Name:
1-methyl-3-(3-methylpyridin-2-yl)urea
InChI:
InChI=1S/C8H11N3O/c1-6-4-3-5-10-7(6)11-8(12)9-2/h3-5H,1-2H3,(H2,9,10,11,12)
InChI Key:
SCOHKAYIHKSJHW-UHFFFAOYSA-N
SMILES:
CNC(=O)Nc1ncccc1C
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.196g/mol
Monoisotopic Mass:
165.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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