Home Other Building Blocks 3-[4-(trifluoromethyl)phenyl]pentan-3-amine hydrochloride

3-[4-(trifluoromethyl)phenyl]pentan-3-amine hydrochloride

CAS No.:
667916-89-4
Catalog Number:
AG01BETR
Molecular Formula:
C12H17ClF3N
Molecular Weight:
267.7183
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Product Description
Catalog Number:
AG01BETR
Chemical Name:
3-[4-(trifluoromethyl)phenyl]pentan-3-amine hydrochloride
CAS Number:
667916-89-4
Molecular Formula:
C12H17ClF3N
Molecular Weight:
267.7183
MDL Number:
MFCD28118432
IUPAC Name:
3-[4-(trifluoromethyl)phenyl]pentan-3-amine;hydrochloride
InChI:
InChI=1S/C12H16F3N.ClH/c1-3-11(16,4-2)9-5-7-10(8-6-9)12(13,14)15;/h5-8H,3-4,16H2,1-2H3;1H
InChI Key:
DEJSGSPPVHKQMU-UHFFFAOYSA-N
SMILES:
CCC(c1ccc(cc1)C(F)(F)F)(CC)N.Cl
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.1g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.72g/mol
Monoisotopic Mass:
267.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties