Home Other Building Blocks 1,1,1-trifluoro-4-methylpentan-3-amine hydrochloride

1,1,1-trifluoro-4-methylpentan-3-amine hydrochloride

CAS No.:
1461704-78-8
Catalog Number:
AG01A64N
Molecular Formula:
C6H13ClF3N
Molecular Weight:
191.6223
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Product Description
Catalog Number:
AG01A64N
Chemical Name:
1,1,1-trifluoro-4-methylpentan-3-amine hydrochloride
CAS Number:
1461704-78-8
Molecular Formula:
C6H13ClF3N
Molecular Weight:
191.6223
MDL Number:
MFCD25371720
IUPAC Name:
1,1,1-trifluoro-4-methylpentan-3-amine;hydrochloride
InChI:
InChI=1S/C6H12F3N.ClH/c1-4(2)5(10)3-6(7,8)9;/h4-5H,3,10H2,1-2H3;1H
InChI Key:
LQCXJBWSVNRMRA-UHFFFAOYSA-N
SMILES:
NC(C(C)C)CC(F)(F)F.Cl
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
191.622g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties