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1349709-00-7

1349709-00-7 | 2-(4-Chloro-phenyl)-4,4,4-trifluoro-butylamine

CAS No: 1349709-00-7 Catalog No: AG01FA1R MDL No:MFCD20233350

Product Description

Catalog Number:
AG01FA1R
Chemical Name:
2-(4-Chloro-phenyl)-4,4,4-trifluoro-butylamine
CAS Number:
1349709-00-7
Molecular Formula:
C10H11ClF3N
Molecular Weight:
237.6492
MDL Number:
MFCD20233350
IUPAC Name:
2-(4-chlorophenyl)-4,4,4-trifluorobutan-1-amine
InChI:
InChI=1S/C10H11ClF3N/c11-9-3-1-7(2-4-9)8(6-15)5-10(12,13)14/h1-4,8H,5-6,15H2
InChI Key:
MGTQWRSWRLZKOA-UHFFFAOYSA-N
SMILES:
NCC(c1ccc(cc1)Cl)CC(F)(F)F

Properties

Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.053g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.65g/mol
Monoisotopic Mass:
237.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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