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Home Aminos 4-(benzyl(methyl)amino)-3,5-difluorobenzoicacid-B28135

4-(benzyl(methyl)amino)-3,5-difluorobenzoicacid-B28135

CAS No.:
1404196-20-8
Catalog Number:
AG019G2L
Molecular Formula:
C15H13F2NO2
Molecular Weight:
277.2660
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Product Description
Catalog Number:
AG019G2L
Chemical Name:
4-(benzyl(methyl)amino)-3,5-difluorobenzoicacid-B28135
CAS Number:
1404196-20-8
Molecular Formula:
C15H13F2NO2
Molecular Weight:
277.2660
MDL Number:
MFCD22580400
IUPAC Name:
4-[benzyl(methyl)amino]-3,5-difluorobenzoic acid
InChI:
InChI=1S/C15H13F2NO2/c1-18(9-10-5-3-2-4-6-10)14-12(16)7-11(15(19)20)8-13(14)17/h2-8H,9H2,1H3,(H,19,20)
InChI Key:
MMNHHHWZKYKLCL-UHFFFAOYSA-N
SMILES:
CN(c1c(F)cc(cc1F)C(=O)O)Cc1ccccc1
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.091g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.271g/mol
Monoisotopic Mass:
277.091g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties