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1431964-62-3 | 3-(2-methoxy-4-methylphenoxy)-1-methyl-1H-pyrazol-4-amine hydrochloride
CAS No: 1431964-62-3 Catalog No: AG01FJZW MDL No:
Product Description
Catalog Number:
AG01FJZW
Chemical Name:
3-(2-methoxy-4-methylphenoxy)-1-methyl-1H-pyrazol-4-amine hydrochloride
CAS Number:
1431964-62-3
Molecular Formula:
C12H16ClN3O2
Molecular Weight:
269.7273
IUPAC Name:
3-(2-methoxy-4-methylphenoxy)-1-methylpyrazol-4-amine;hydrochloride
InChI:
InChI=1S/C12H15N3O2.ClH/c1-8-4-5-10(11(6-8)16-3)17-12-9(13)7-15(2)14-12;/h4-7H,13H2,1-3H3;1H
InChI Key:
ZBKAKRDGCKXAIR-UHFFFAOYSA-N
SMILES:
COc1cc(C)ccc1Oc1nn(cc1N)C.Cl
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.093g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.729g/mol
Monoisotopic Mass:
269.093g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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