3-Chloro-2-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)aniline - CAS 937604-47-2
Catalog: |
BB047632 |
Product Name: |
3-Chloro-2-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)aniline |
CAS: |
937604-47-2 |
Synonyms: |
3-chloro-2-[3-(trifluoromethyl)(1H-4,5,6,7-tetrahydroindazolyl)]phenylamine |
IUPAC Name: | 3-chloro-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]aniline |
Description: | 3-Chloro-2-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)aniline (CAS# 937604-47-2 ) is a useful research chemical. |
Molecular Weight: | 315.72 |
Molecular Formula: | C14H13ClF3N3 |
Canonical SMILES: | C1CCC2=C(C1)C(=NN2C3=C(C=CC=C3Cl)N)C(F)(F)F |
InChI: | InChI=1S/C14H13ClF3N3/c15-9-5-3-6-10(19)12(9)21-11-7-2-1-4-8(11)13(20-21)14(16,17)18/h3,5-6H,1-2,4,7,19H2 |
InChI Key: | JUTJLYGVIHJFHO-UHFFFAOYSA-N |
Boiling Point: | 407.0±45.0 °C at 760 mmHg |
Density: | 1.51±0.1 g/cm3 |
Complexity: | 379 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 315.0750096 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 315.0750096 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4 |
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