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1263282-44-5 | 2-Butanamine, 1,1,1-trifluoro-3-methyl-, hydrochloride (1:1)
CAS No: 1263282-44-5 Catalog No: AG000SLR MDL No:MFCD16875525
Product Description
Catalog Number:
AG000SLR
Chemical Name:
2-Butanamine, 1,1,1-trifluoro-3-methyl-, hydrochloride (1:1)
CAS Number:
1263282-44-5
Molecular Formula:
C5H11ClF3N
Molecular Weight:
177.5957
MDL Number:
MFCD16875525
IUPAC Name:
1,1,1-trifluoro-3-methylbutan-2-amine;hydrochloride
InChI:
InChI=1S/C5H10F3N.ClH/c1-3(2)4(9)5(6,7)8;/h3-4H,9H2,1-2H3;1H
InChI Key:
WBDZKNFDWWBZJN-UHFFFAOYSA-N
SMILES:
NC(C(F)(F)F)C(C)C.Cl
Properties
Complexity:
86.7
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:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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