Home Other Building Blocks L-Proline, 4,4-difluoro-, hydrochloride (1:1)

L-Proline, 4,4-difluoro-, hydrochloride (1:1)

CAS No.:
1588480-37-8
Catalog Number:
AG001QY5
Molecular Formula:
C5H8ClF2NO2
Molecular Weight:
187.5723
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Product Description
Catalog Number:
AG001QY5
Chemical Name:
L-Proline, 4,4-difluoro-, hydrochloride (1:1)
CAS Number:
1588480-37-8
Molecular Formula:
C5H8ClF2NO2
Molecular Weight:
187.5723
MDL Number:
MFCD22199978
IUPAC Name:
(2S)-4,4-difluoropyrrolidine-2-carboxylic acid;hydrochloride
InChI:
InChI=1S/C5H7F2NO2.ClH/c6-5(7)1-3(4(9)10)8-2-5;/h3,8H,1-2H2,(H,9,10);1H/t3-;/m0./s1
InChI Key:
QGRXWQRKPNNHMU-DFWYDOINSA-N
SMILES:
OC(=O)[C@H]1NCC(C1)(F)F.Cl
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
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:
1  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties