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Home > Fluorides > 1197238-95-1
1197238-95-1 | Pyrrolidine, 2-(2,5-difluorophenyl)-, hydrochloride (1:1)
CAS No: 1197238-95-1 Catalog No: AG000PK9 MDL No:MFCD08456909
Product Description
Catalog Number:
AG000PK9
Chemical Name:
Pyrrolidine, 2-(2,5-difluorophenyl)-, hydrochloride (1:1)
CAS Number:
1197238-95-1
Molecular Formula:
C10H12ClF2N
Molecular Weight:
219.6588
MDL Number:
MFCD08456909
IUPAC Name:
2-(2,5-difluorophenyl)pyrrolidine;hydrochloride
InChI:
InChI=1S/C10H11F2N.ClH/c11-7-3-4-9(12)8(6-7)10-2-1-5-13-10;/h3-4,6,10,13H,1-2,5H2;1H
InChI Key:
XSWCQOVADZHFIJ-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C1CCCN1)F.Cl
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
219.66g/mol
Monoisotopic Mass:
219.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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