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7390-56-9 | 5-METHYL-2-THIOCYTOSINE
CAS No: 7390-56-9 Catalog No: AG005AL5 MDL No:
Product Description
Catalog Number:
AG005AL5
Chemical Name:
5-METHYL-2-THIOCYTOSINE
CAS Number:
7390-56-9
Molecular Formula:
C5H7N3S
Molecular Weight:
141.1942
IUPAC Name:
6-amino-5-methyl-1H-pyrimidine-2-thione
InChI:
InChI=1S/C5H7N3S/c1-3-2-7-5(9)8-4(3)6/h2H,1H3,(H3,6,7,8,9)
InChI Key:
AMWMJLDWNRVVIC-UHFFFAOYSA-N
SMILES:
Cc1c[nH]c(=S)nc1N
NSC Number:
154907
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.036g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
141.192g/mol
Monoisotopic Mass:
141.036g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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