Home Other Building Blocks 4,4,4-trifluoro-2-methylbutan-1-amine hydrochloride

4,4,4-trifluoro-2-methylbutan-1-amine hydrochloride

CAS No.:
136564-89-1
Catalog Number:
AG01C33N
Molecular Formula:
C5H11ClF3N
Molecular Weight:
177.5957
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Product Description
Catalog Number:
AG01C33N
Chemical Name:
4,4,4-trifluoro-2-methylbutan-1-amine hydrochloride
CAS Number:
136564-89-1
Molecular Formula:
C5H11ClF3N
Molecular Weight:
177.5957
MDL Number:
MFCD29055206
IUPAC Name:
4,4,4-trifluoro-2-methylbutan-1-amine;hydrochloride
InChI:
InChI=1S/C5H10F3N.ClH/c1-4(3-9)2-5(6,7)8;/h4H,2-3,9H2,1H3;1H
InChI Key:
PKZZMNUWBBIRHO-UHFFFAOYSA-N
SMILES:
NCC(CC(F)(F)F)C.Cl
Properties
Complexity:
78.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.053g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
177.595g/mol
Monoisotopic Mass:
177.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties