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88660-72-4 | Benzenecarboximidamide, N-[(2,5,6-trichloro-4-pyrimidinyl)oxy]-
CAS No: 88660-72-4 Catalog No: AG0048IG MDL No:
Product Description
Catalog Number:
AG0048IG
Chemical Name:
Benzenecarboximidamide, N-[(2,5,6-trichloro-4-pyrimidinyl)oxy]-
CAS Number:
88660-72-4
Molecular Formula:
C11H7Cl3N4O
Molecular Weight:
317.5585
IUPAC Name:
N'-(2,5,6-trichloropyrimidin-4-yl)oxybenzenecarboximidamide
InChI:
InChI=1S/C11H7Cl3N4O/c12-7-8(13)16-11(14)17-10(7)19-18-9(15)6-4-2-1-3-5-6/h1-5H,(H2,15,18)
InChI Key:
FVWKYFGPYHIVBP-UHFFFAOYSA-N
SMILES:
Clc1nc(ONC(=N)c2ccccc2)c(c(n1)Cl)Cl
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.969g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.554g/mol
Monoisotopic Mass:
315.969g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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