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Home > Fluorides > 130066-24-9
130066-24-9 | Guanidine, N-[4-(trifluoromethyl)phenyl]-
CAS No: 130066-24-9 Catalog No: AG000TZ4 MDL No:MFCD10000732
Product Description
Catalog Number:
AG000TZ4
Chemical Name:
Guanidine, N-[4-(trifluoromethyl)phenyl]-
CAS Number:
130066-24-9
Molecular Formula:
C8H8F3N3
Molecular Weight:
203.1644
MDL Number:
MFCD10000732
IUPAC Name:
2-[4-(trifluoromethyl)phenyl]guanidine
InChI:
InChI=1S/C8H8F3N3/c9-8(10,11)5-1-3-6(4-2-5)14-7(12)13/h1-4H,(H4,12,13,14)
InChI Key:
IUNFWMWQNWQIFS-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1ccc(cc1)C(F)(F)F
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.067g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
203.168g/mol
Monoisotopic Mass:
203.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Selective urokinase-type plasminogen activator inhibitors. 4. 1-(7-sulfonamidoisoquinolinyl)guanidines. | Journal of medicinal chemistry 20070517 |
| The binding of arylguanidines at 5-HT(3) serotonin receptors: a structure-affinity investigation. | Bioorganic & medicinal chemistry letters 20010618 |
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