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Home > Fluorides > 1197233-93-4
1197233-93-4 | 4-(2,2,2-Trifluoroethyl)aniline hydrochloride
CAS No: 1197233-93-4 Catalog No: AG01FA91 MDL No:MFCD09758982
Product Description
Catalog Number:
AG01FA91
Chemical Name:
4-(2,2,2-Trifluoroethyl)aniline hydrochloride
CAS Number:
1197233-93-4
Molecular Formula:
C8H9ClF3N
Molecular Weight:
211.6120
MDL Number:
MFCD09758982
IUPAC Name:
4-(2,2,2-trifluoroethyl)aniline;hydrochloride
InChI:
InChI=1S/C8H8F3N.ClH/c9-8(10,11)5-6-1-3-7(12)4-2-6;/h1-4H,5,12H2;1H
InChI Key:
NLMBBKDRGDSUGK-UHFFFAOYSA-N
SMILES:
FC(Cc1ccc(cc1)N)(F)F.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.038g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.612g/mol
Monoisotopic Mass:
211.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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