Home Aminos 4-amino-3-(difluoromethyl)butanoic acid hydrochloride

4-amino-3-(difluoromethyl)butanoic acid hydrochloride

CAS No.:
1378736-74-3
Catalog Number:
AG01BBO4
Molecular Formula:
C5H10ClF2NO2
Molecular Weight:
189.5882
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Product Description
Catalog Number:
AG01BBO4
Chemical Name:
4-amino-3-(difluoromethyl)butanoic acid hydrochloride
CAS Number:
1378736-74-3
Molecular Formula:
C5H10ClF2NO2
Molecular Weight:
189.5882
MDL Number:
MFCD20660558
IUPAC Name:
3-(aminomethyl)-4,4-difluorobutanoic acid;hydrochloride
InChI:
InChI=1S/C5H9F2NO2.ClH/c6-5(7)3(2-8)1-4(9)10;/h3,5H,1-2,8H2,(H,9,10);1H
InChI Key:
QCDOUPOAESIDOU-UHFFFAOYSA-N
SMILES:
NCC(C(F)F)CC(=O)O.Cl
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.037g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
189.587g/mol
Monoisotopic Mass:
189.037g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties