Home Other Building Blocks 4-(pentafluoroethyl)aniline hydrochloride

4-(pentafluoroethyl)aniline hydrochloride

CAS No.:
60979-02-4
Catalog Number:
AG01A5C7
Molecular Formula:
C8H7ClF5N
Molecular Weight:
247.5929
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Product Description
Catalog Number:
AG01A5C7
Chemical Name:
4-(pentafluoroethyl)aniline hydrochloride
CAS Number:
60979-02-4
Molecular Formula:
C8H7ClF5N
Molecular Weight:
247.5929
MDL Number:
MFCD26935948
IUPAC Name:
4-(1,1,2,2,2-pentafluoroethyl)aniline;hydrochloride
InChI:
InChI=1S/C8H6F5N.ClH/c9-7(10,8(11,12)13)5-1-3-6(14)4-2-5;/h1-4H,14H2;1H
InChI Key:
OFHOLOUZCUXTJJ-UHFFFAOYSA-N
SMILES:
FC(C(F)(F)F)(c1ccc(cc1)N)F.Cl
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.019g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.593g/mol
Monoisotopic Mass:
247.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties