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87980-85-6 | Acetamide, 2,2,2-trifluoro-N-[2-[4-(2-hydroxyethyl)-1-piperazinyl]ethyl]-
CAS No: 87980-85-6 Catalog No: AG004LMB MDL No:
Product Description
Catalog Number:
AG004LMB
Chemical Name:
Acetamide, 2,2,2-trifluoro-N-[2-[4-(2-hydroxyethyl)-1-piperazinyl]ethyl]-
CAS Number:
87980-85-6
Molecular Formula:
C10H18F3N3O2
Molecular Weight:
269.2640
IUPAC Name:
2,2,2-trifluoro-N-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
InChI:
InChI=1S/C10H18F3N3O2/c11-10(12,13)9(18)14-1-2-15-3-5-16(6-4-15)7-8-17/h17H,1-8H2,(H,14,18)
InChI Key:
DJXYNLOZRRMURJ-UHFFFAOYSA-N
SMILES:
OCCN1CCN(CC1)CCNC(=O)C(F)(F)F
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.135g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.268g/mol
Monoisotopic Mass:
269.135g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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