Name: Name:3-Acetamido-2-nitrophenyl 4-(dimethylamino)-3,5-difluorobenzoate
Brand: Angene
SKU: AG01D8RM
Rating: 90 (10 reviews)

3-Acetamido-2-nitrophenyl 4-(dimethylamino)-3,5-difluorobenzoate

CAS No.:

1864063-33-1

Catalog Number:

AG01D8RM

Molecular Formula:

C17H15F2N3O5

Molecular Weight:

379.3149

Catalog Number:

AG01D8RM

Chemical Name:

3-Acetamido-2-nitrophenyl 4-(dimethylamino)-3,5-difluorobenzoate

CAS Number:

1864063-33-1

Molecular Formula:

C17H15F2N3O5

Molecular Weight:

379.3149

MDL Number:

MFCD27978603

IUPAC Name:

(3-acetamido-2-nitrophenyl) 4-(dimethylamino)-3,5-difluorobenzoate

InChI:

InChI=1S/C17H15F2N3O5/c1-9(23)20-13-5-4-6-14(16(13)22(25)26)27-17(24)10-7-11(18)15(21(2)3)12(19)8-10/h4-8H,1-3H3,(H,20,23)

InChI Key:

LDTFCGPEBKAICA-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1cccc(c1[N+](=O)[O-])OC(=O)c1cc(F)c(c(c1)F)N(C)C

Complexity:

559

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

379.098g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

379.32g/mol

Monoisotopic Mass:

379.098g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

105A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2