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Home > Nitro Compounds > 62641-67-2
62641-67-2 | 1-nitroso-5,6-dihydrothymine
CAS No: 62641-67-2 Catalog No: AG00F5LG MDL No:
Product Description
Catalog Number:
AG00F5LG
Chemical Name:
1-nitroso-5,6-dihydrothymine
CAS Number:
62641-67-2
IUPAC Name:
5-methyl-1-nitroso-1,3-diazinane-2,4-dione
InChI:
InChI=1S/C5H7N3O3/c1-3-2-8(7-11)5(10)6-4(3)9/h3H,2H2,1H3,(H,6,9,10)
InChI Key:
VHNPZOQVSSWOJZ-UHFFFAOYSA-N
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.049g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.129g/mol
Monoisotopic Mass:
157.049g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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