Home Other Building Blocks 3-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-indole

3-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-indole

CAS No.:
1774374-53-6
Catalog Number:
AG01BH4M
Molecular Formula:
C13H13F3N2
Molecular Weight:
254.2509
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Product Description
Catalog Number:
AG01BH4M
Chemical Name:
3-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-indole
CAS Number:
1774374-53-6
Molecular Formula:
C13H13F3N2
Molecular Weight:
254.2509
MDL Number:
MFCD29991240
IUPAC Name:
3-[2-(trifluoromethyl)pyrrolidin-2-yl]-1H-indole
InChI:
InChI=1S/C13H13F3N2/c14-13(15,16)12(6-3-7-18-12)10-8-17-11-5-2-1-4-9(10)11/h1-2,4-5,8,17-18H,3,6-7H2
InChI Key:
UKEAFAYLWOXNKP-UHFFFAOYSA-N
SMILES:
FC(C1(CCCN1)c1c[nH]c2c1cccc2)(F)F
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.103g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
254.256g/mol
Monoisotopic Mass:
254.103g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
27.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties