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88660-68-8 | Ethanimidamide, N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]-
CAS No: 88660-68-8 Catalog No: AG0048IH MDL No:
Product Description
Catalog Number:
AG0048IH
Chemical Name:
Ethanimidamide, N-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]-
CAS Number:
88660-68-8
Molecular Formula:
C7H11N5O3
Molecular Weight:
213.1939
IUPAC Name:
N'-[(4,6-dimethoxy-1,3,5-triazin-2-yl)oxy]ethanimidamide
InChI:
InChI=1S/C7H11N5O3/c1-4(8)12-15-7-10-5(13-2)9-6(11-7)14-3/h1-3H3,(H2,8,12)
InChI Key:
LSVLHGJAPWWBMN-UHFFFAOYSA-N
SMILES:
COc1nc(ONC(=N)C)nc(n1)OC
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.086g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.197g/mol
Monoisotopic Mass:
213.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.3
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