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102766-74-5 | Benzenamine, 2-methyl-4-[4-(trifluoromethyl)phenoxy]-
CAS No: 102766-74-5 Catalog No: AG0008BT MDL No:MFCD04973006
Product Description
Catalog Number:
AG0008BT
Chemical Name:
Benzenamine, 2-methyl-4-[4-(trifluoromethyl)phenoxy]-
CAS Number:
102766-74-5
Molecular Formula:
C14H12F3NO
Molecular Weight:
267.2464
MDL Number:
MFCD04973006
IUPAC Name:
2-methyl-4-[4-(trifluoromethyl)phenoxy]aniline
InChI:
InChI=1S/C14H12F3NO/c1-9-8-12(6-7-13(9)18)19-11-4-2-10(3-5-11)14(15,16)17/h2-8H,18H2,1H3
InChI Key:
XEZSBTYKZOAQQK-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1C)Oc1ccc(cc1)C(F)(F)F
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.087g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.251g/mol
Monoisotopic Mass:
267.087g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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