Home Other Building Blocks 4-(3,5-dimethyl-1H-pyrazol-1-yl)benzene-1-carboximidamide, acetic acid

4-(3,5-dimethyl-1H-pyrazol-1-yl)benzene-1-carboximidamide, acetic acid

CAS No.:
1909314-25-5
Catalog Number:
AG01B1WV
Molecular Formula:
C14H18N4O2
Molecular Weight:
274.3183
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Product Description
Catalog Number:
AG01B1WV
Chemical Name:
4-(3,5-dimethyl-1H-pyrazol-1-yl)benzene-1-carboximidamide, acetic acid
CAS Number:
1909314-25-5
Molecular Formula:
C14H18N4O2
Molecular Weight:
274.3183
MDL Number:
MFCD29907212
IUPAC Name:
acetic acid;4-(3,5-dimethylpyrazol-1-yl)benzenecarboximidamide
InChI:
InChI=1S/C12H14N4.C2H4O2/c1-8-7-9(2)16(15-8)11-5-3-10(4-6-11)12(13)14;1-2(3)4/h3-7H,1-2H3,(H3,13,14);1H3,(H,3,4)
InChI Key:
YIHZOIYSEDYIOR-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C)c1ccc(cc1)C(=N)N.CC(=O)O
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.143g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
274.324g/mol
Monoisotopic Mass:
274.143g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties