200,000+ products from a single source!
sales@angenechem.com
76510-61-7 | 4(3H)-Pyrimidinone,5-iodo-2-(methylthio)-
CAS No: 76510-61-7 Catalog No: AG005BLO MDL No:MFCD20482161
Product Description
Catalog Number:
AG005BLO
Chemical Name:
4(3H)-Pyrimidinone,5-iodo-2-(methylthio)-
CAS Number:
76510-61-7
Molecular Formula:
C5H5IN2OS
Molecular Weight:
268.0755
MDL Number:
MFCD20482161
IUPAC Name:
5-iodo-2-methylsulfanyl-1H-pyrimidin-6-one
InChI:
InChI=1S/C5H5IN2OS/c1-10-5-7-2-3(6)4(9)8-5/h2H,1H3,(H,7,8,9)
InChI Key:
WTHKWCNGAAYWAQ-UHFFFAOYSA-N
SMILES:
CSc1ncc(c(n1)O)I
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.917g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.072g/mol
Monoisotopic Mass:
267.917g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.