Home Carboxys 1-tert-butyl-3-fluoropyrrolidine-3-carboxylic acid hydrochloride

1-tert-butyl-3-fluoropyrrolidine-3-carboxylic acid hydrochloride

CAS No.:
1803584-91-9
Catalog Number:
AG01BCE4
Molecular Formula:
C9H17ClFNO2
Molecular Weight:
225.6882
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Product Description
Catalog Number:
AG01BCE4
Chemical Name:
1-tert-butyl-3-fluoropyrrolidine-3-carboxylic acid hydrochloride
CAS Number:
1803584-91-9
Molecular Formula:
C9H17ClFNO2
Molecular Weight:
225.6882
MDL Number:
MFCD28714790
IUPAC Name:
1-tert-butyl-3-fluoropyrrolidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C9H16FNO2.ClH/c1-8(2,3)11-5-4-9(10,6-11)7(12)13;/h4-6H2,1-3H3,(H,12,13);1H
InChI Key:
LMYRPWSIECOCCB-UHFFFAOYSA-N
SMILES:
OC(=O)C1(F)CCN(C1)C(C)(C)C.Cl
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.093g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
225.688g/mol
Monoisotopic Mass:
225.093g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties