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Home > Fluorides > 1250228-33-1
1250228-33-1 | "[1-(3-fluoro-4-methylphenyl)-1H-1,2,3-triazol-4-yl]methanol"
CAS No: 1250228-33-1 Catalog No: AG01FM5L MDL No:MFCD16747678
Product Description
Catalog Number:
AG01FM5L
Chemical Name:
"[1-(3-fluoro-4-methylphenyl)-1H-1,2,3-triazol-4-yl]methanol"
CAS Number:
1250228-33-1
Molecular Formula:
C10H10FN3O
Molecular Weight:
207.2043
MDL Number:
MFCD16747678
IUPAC Name:
[1-(3-fluoro-4-methylphenyl)triazol-4-yl]methanol
InChI:
InChI=1S/C10H10FN3O/c1-7-2-3-9(4-10(7)11)14-5-8(6-15)12-13-14/h2-5,15H,6H2,1H3
InChI Key:
OSKUDTIOPBAFPZ-UHFFFAOYSA-N
SMILES:
OCc1nnn(c1)c1ccc(c(c1)F)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.081g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.208g/mol
Monoisotopic Mass:
207.081g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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