Home Other Building Blocks [4-((2R)PYRROLIDIN-2-YL)PHENOXY]TRIFLUOROMETHANE HYDROCHLORIDE

[4-((2R)PYRROLIDIN-2-YL)PHENOXY]TRIFLUOROMETHANE HYDROCHLORIDE

CAS No.:
1391490-20-2
Catalog Number:
AG01DU7B
Molecular Formula:
C11H13ClF3NO
Molecular Weight:
267.6752
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Product Description
Catalog Number:
AG01DU7B
Chemical Name:
[4-((2R)PYRROLIDIN-2-YL)PHENOXY]TRIFLUOROMETHANE HYDROCHLORIDE
CAS Number:
1391490-20-2
Molecular Formula:
C11H13ClF3NO
Molecular Weight:
267.6752
MDL Number:
MFCD12910679
IUPAC Name:
2-[4-(trifluoromethoxy)phenyl]pyrrolidine;hydrochloride
InChI:
InChI=1S/C11H12F3NO.ClH/c12-11(13,14)16-9-5-3-8(4-6-9)10-2-1-7-15-10;/h3-6,10,15H,1-2,7H2;1H
InChI Key:
CQVGKBSZXQYCTD-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1)[C@H]1CCCN1)(F)F.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:
267.064g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.676g/mol
Monoisotopic Mass:
267.064g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties