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209224-89-5 | 1H-Pyrazol-3-amine, 5-(1-naphthalenyl)-
CAS No: 209224-89-5 Catalog No: AG002K40 MDL No:
Product Description
Catalog Number:
AG002K40
Chemical Name:
1H-Pyrazol-3-amine, 5-(1-naphthalenyl)-
CAS Number:
209224-89-5
Molecular Formula:
C13H11N3
Molecular Weight:
209.2465
IUPAC Name:
5-naphthalen-1-yl-1H-pyrazol-3-amine
InChI:
InChI=1S/C13H11N3/c14-13-8-12(15-16-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H3,14,15,16)
InChI Key:
WREXGNDJZBDHPT-UHFFFAOYSA-N
SMILES:
Nc1n[nH]c(c1)c1cccc2c1cccc2
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
209.252g/mol
Monoisotopic Mass:
209.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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