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102739-42-4 | Cyanamide, N-(4,6-dimethoxy-2-pyrimidinyl)-
CAS No: 102739-42-4 Catalog No: AG00089Q MDL No:
Product Description
Catalog Number:
AG00089Q
Chemical Name:
Cyanamide, N-(4,6-dimethoxy-2-pyrimidinyl)-
CAS Number:
102739-42-4
Molecular Formula:
C7H8N4O2
Molecular Weight:
180.1640
IUPAC Name:
(4,6-dimethoxypyrimidin-2-yl)cyanamide
InChI:
InChI=1S/C7H8N4O2/c1-12-5-3-6(13-2)11-7(10-5)9-4-8/h3H,1-2H3,(H,9,10,11)
InChI Key:
NIFWDEYDGSTTOM-UHFFFAOYSA-N
SMILES:
COc1nc(NC#N)nc(c1)OC
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.065g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.167g/mol
Monoisotopic Mass:
180.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
80.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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