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Home > Fluorides > 1421508-23-7
1421508-23-7 | N-Methyl-N-(4-(trifluoromethyl)benzo[d]thiazol-2-yl)glycine
CAS No: 1421508-23-7 Catalog No: AG01FN01 MDL No:MFCD22587772
Product Description
Catalog Number:
AG01FN01
Chemical Name:
N-Methyl-N-(4-(trifluoromethyl)benzo[d]thiazol-2-yl)glycine
CAS Number:
1421508-23-7
Molecular Formula:
C11H9F3N2O2S
Molecular Weight:
290.2616
MDL Number:
MFCD22587772
IUPAC Name:
2-[methyl-[4-(trifluoromethyl)-1,3-benzothiazol-2-yl]amino]acetic acid
InChI:
InChI=1S/C11H9F3N2O2S/c1-16(5-8(17)18)10-15-9-6(11(12,13)14)3-2-4-7(9)19-10/h2-4H,5H2,1H3,(H,17,18)
InChI Key:
YJUFAUMJPFXOQT-UHFFFAOYSA-N
SMILES:
OC(=O)CN(c1sc2c(n1)c(ccc2)C(F)(F)F)C
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.034g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.26g/mol
Monoisotopic Mass:
290.034g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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