Home Aminos methyl 2-amino-4,4-difluorobutanoate hydrochloride

methyl 2-amino-4,4-difluorobutanoate hydrochloride

CAS No.:
1192000-88-6
Catalog Number:
AG01A3C6
Molecular Formula:
C5H10ClF2NO2
Molecular Weight:
189.5882
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Product Description
Catalog Number:
AG01A3C6
Chemical Name:
methyl 2-amino-4,4-difluorobutanoate hydrochloride
CAS Number:
1192000-88-6
Molecular Formula:
C5H10ClF2NO2
Molecular Weight:
189.5882
MDL Number:
MFCD22741232
IUPAC Name:
methyl 2-amino-4,4-difluorobutanoate;hydrochloride
InChI:
InChI=1S/C5H9F2NO2.ClH/c1-10-5(9)3(8)2-4(6)7;/h3-4H,2,8H2,1H3;1H
InChI Key:
LTLMGMDHRNVCAJ-UHFFFAOYSA-N
SMILES:
COC(=O)C(CC(F)F)N.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:
2  
Isotope Atom Count:
0
Molecular Weight:
189.587g/mol
Monoisotopic Mass:
189.037g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties