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1176630-17-3 | 1H-Indazol-5-amine, 3-(4-methylphenyl)-
CAS No: 1176630-17-3 Catalog No: AG000HMR MDL No:
Product Description
Catalog Number:
AG000HMR
Chemical Name:
1H-Indazol-5-amine, 3-(4-methylphenyl)-
CAS Number:
1176630-17-3
Molecular Formula:
C14H13N3
Molecular Weight:
223.2731
IUPAC Name:
3-(4-methylphenyl)-1H-indazol-5-amine
InChI:
InChI=1S/C14H13N3/c1-9-2-4-10(5-3-9)14-12-8-11(15)6-7-13(12)16-17-14/h2-8H,15H2,1H3,(H,16,17)
InChI Key:
BFNHDSZLRTZEMG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1n[nH]c2c1cc(N)cc2
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.279g/mol
Monoisotopic Mass:
223.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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