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56035-75-7 |
CAS No: 56035-75-7 Catalog No: AG01FMN4 MDL No:
Product Description
Catalog Number:
AG01FMN4
CAS Number:
56035-75-7
IUPAC Name:
4-chloro-6-methoxy-2-methylsulfanylpyrimidine-5-carbonitrile
InChI:
InChI=1S/C7H6ClN3OS/c1-12-6-4(3-9)5(8)10-7(11-6)13-2/h1-2H3
InChI Key:
PSWOBMYZCCPQKT-UHFFFAOYSA-N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.992g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.655g/mol
Monoisotopic Mass:
214.992g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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