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1349718-90-6 | 2-(2-Methoxyethyl)-5-phenyl-2H-pyrazol-3-ylamine
CAS No: 1349718-90-6 Catalog No: AG01F9I9 MDL No:
Product Description
Catalog Number:
AG01F9I9
Chemical Name:
2-(2-Methoxyethyl)-5-phenyl-2H-pyrazol-3-ylamine
CAS Number:
1349718-90-6
Molecular Formula:
C12H15N3O
Molecular Weight:
217.2670
IUPAC Name:
2-(2-methoxyethyl)-5-phenylpyrazol-3-amine
InChI:
InChI=1S/C12H15N3O/c1-16-8-7-15-12(13)9-11(14-15)10-5-3-2-4-6-10/h2-6,9H,7-8,13H2,1H3
InChI Key:
WSMIHRMRNNMGGS-UHFFFAOYSA-N
SMILES:
COCCn1nc(cc1N)c1ccccc1
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.122g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.272g/mol
Monoisotopic Mass:
217.122g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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