Home Carboxys 1-(aminomethyl)-2,2-difluorocyclopropane-1-carboxylic acid hydrochloride

1-(aminomethyl)-2,2-difluorocyclopropane-1-carboxylic acid hydrochloride

CAS No.:
2098054-46-5
Catalog Number:
AG01ELKV
Molecular Formula:
C5H8ClF2NO2
Molecular Weight:
187.5723
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Product Description
Catalog Number:
AG01ELKV
Chemical Name:
1-(aminomethyl)-2,2-difluorocyclopropane-1-carboxylic acid hydrochloride
CAS Number:
2098054-46-5
Molecular Formula:
C5H8ClF2NO2
Molecular Weight:
187.5723
MDL Number:
MFCD30494323
IUPAC Name:
1-(aminomethyl)-2,2-difluorocyclopropane-1-carboxylic acid;hydrochloride
InChI:
InChI=1S/C5H7F2NO2.ClH/c6-5(7)1-4(5,2-8)3(9)10;/h1-2,8H2,(H,9,10);1H
InChI Key:
MSGZDEQSZMASIJ-UHFFFAOYSA-N
SMILES:
NCC1(CC1(F)F)C(=O)O.Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.021g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
187.571g/mol
Monoisotopic Mass:
187.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties