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Home > Fluorides > 1006037-09-7
1006037-09-7 | Thiophene, 2,5-diMethyl-3-[[4-(trifluoroMethyl)phenyl]Methyl]-
CAS No: 1006037-09-7 Catalog No: AG0002GA MDL No:MFCD17926241
Product Description
Catalog Number:
AG0002GA
Chemical Name:
Thiophene, 2,5-diMethyl-3-[[4-(trifluoroMethyl)phenyl]Methyl]-
CAS Number:
1006037-09-7
Molecular Formula:
C14H13F3S
Molecular Weight:
270.3132
MDL Number:
MFCD17926241
IUPAC Name:
2,5-dimethyl-3-[[4-(trifluoromethyl)phenyl]methyl]thiophene
InChI:
InChI=1S/C14H13F3S/c1-9-7-12(10(2)18-9)8-11-3-5-13(6-4-11)14(15,16)17/h3-7H,8H2,1-2H3
InChI Key:
PXNRSYKOHWZGSK-UHFFFAOYSA-N
SMILES:
Cc1sc(c(c1)Cc1ccc(cc1)C(F)(F)F)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.069g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.313g/mol
Monoisotopic Mass:
270.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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