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Home > Fluorides > 1395031-65-8
1395031-65-8 | 4-[2-(Trifluoromethyl)pyrrolidin-1-yl]aniline
CAS No: 1395031-65-8 Catalog No: AG01FACI MDL No:MFCD22566319
Product Description
Catalog Number:
AG01FACI
Chemical Name:
4-[2-(Trifluoromethyl)pyrrolidin-1-yl]aniline
CAS Number:
1395031-65-8
Molecular Formula:
C11H13F3N2
Molecular Weight:
230.2295
MDL Number:
MFCD22566319
IUPAC Name:
4-[2-(trifluoromethyl)pyrrolidin-1-yl]aniline
InChI:
InChI=1S/C11H13F3N2/c12-11(13,14)10-2-1-7-16(10)9-5-3-8(15)4-6-9/h3-6,10H,1-2,7,15H2
InChI Key:
CLJVIYRZQWRFSW-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)N1CCCC1C(F)(F)F
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.103g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.234g/mol
Monoisotopic Mass:
230.103g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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