Home Other Building Blocks 1-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-5-amine hydrochloride

1-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-5-amine hydrochloride

CAS No.:
1052544-71-4
Catalog Number:
AG019OUC
Molecular Formula:
C12H16ClN3O2
Molecular Weight:
269.7273
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Product Description
Catalog Number:
AG019OUC
Chemical Name:
1-[(2,3-dimethoxyphenyl)methyl]-1H-pyrazol-5-amine hydrochloride
CAS Number:
1052544-71-4
Molecular Formula:
C12H16ClN3O2
Molecular Weight:
269.7273
MDL Number:
MFCD07687284
IUPAC Name:
2-[(2,3-dimethoxyphenyl)methyl]pyrazol-3-amine;hydrochloride
InChI:
InChI=1S/C12H15N3O2.ClH/c1-16-10-5-3-4-9(12(10)17-2)8-15-11(13)6-7-14-15;/h3-7H,8,13H2,1-2H3;1H
InChI Key:
PDLZZUHZBHDXJH-UHFFFAOYSA-N
SMILES:
COc1c(OC)cccc1Cn1nccc1N.Cl
Properties
Complexity:
240  
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:
4  
Topological Polar Surface Area:
62.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties