Home Aminos 3-amino-4,4,4-trifluorobutan-1-ol hydrochloride

3-amino-4,4,4-trifluorobutan-1-ol hydrochloride

CAS No.:
1955518-76-9
Catalog Number:
AG01ALWL
Molecular Formula:
C4H9ClF3NO
Molecular Weight:
179.5686
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Product Description
Catalog Number:
AG01ALWL
Chemical Name:
3-amino-4,4,4-trifluorobutan-1-ol hydrochloride
CAS Number:
1955518-76-9
Molecular Formula:
C4H9ClF3NO
Molecular Weight:
179.5686
MDL Number:
MFCD27644683
IUPAC Name:
3-amino-4,4,4-trifluorobutan-1-ol;hydrochloride
InChI:
InChI=1S/C4H8F3NO.ClH/c5-4(6,7)3(8)1-2-9;/h3,9H,1-2,8H2;1H
InChI Key:
NRAPSDJOBAOKER-UHFFFAOYSA-N
SMILES:
OCCC(C(F)(F)F)N.Cl
Properties
Complexity:
82.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.032g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
179.567g/mol
Monoisotopic Mass:
179.032g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties