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1236862-38-6 | Azetidine, 3-[4-(trifluoromethyl)phenoxy]-, hydrochloride (1:1)
CAS No: 1236862-38-6 Catalog No: AG000KXX MDL No:MFCD18071794
Product Description
Catalog Number:
AG000KXX
Chemical Name:
Azetidine, 3-[4-(trifluoromethyl)phenoxy]-, hydrochloride (1:1)
CAS Number:
1236862-38-6
Molecular Formula:
C10H11ClF3NO
Molecular Weight:
253.6486
MDL Number:
MFCD18071794
IUPAC Name:
3-[4-(trifluoromethyl)phenoxy]azetidine;hydrochloride
InChI:
InChI=1S/C10H10F3NO.ClH/c11-10(12,13)7-1-3-8(4-2-7)15-9-5-14-6-9;/h1-4,9,14H,5-6H2;1H
InChI Key:
ABQHNGFCRJATSS-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)OC1CNC1)(F)F.Cl
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.048g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
253.649g/mol
Monoisotopic Mass:
253.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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