Name: Name:3-Thiophenecarboxylic acid, 2-amino-4-methyl-5-(4-nitrophenyl)-, ethyl ester
Brand: Angene
SKU: AG001ZFS
Rating: 90 (10 reviews)

3-Thiophenecarboxylic acid, 2-amino-4-methyl-5-(4-nitrophenyl)-, ethyl ester

CAS No.:

174072-89-0

Catalog Number:

AG001ZFS

Molecular Formula:

C14H14N2O4S

Molecular Weight:

306.3370

Catalog Number:

AG001ZFS

Chemical Name:

3-Thiophenecarboxylic acid, 2-amino-4-methyl-5-(4-nitrophenyl)-, ethyl ester

CAS Number:

174072-89-0

Molecular Formula:

C14H14N2O4S

Molecular Weight:

306.3370

MDL Number:

MFCD04115279

IUPAC Name:

ethyl 2-amino-4-methyl-5-(4-nitrophenyl)thiophene-3-carboxylate

InChI:

InChI=1S/C14H14N2O4S/c1-3-20-14(17)11-8(2)12(21-13(11)15)9-4-6-10(7-5-9)16(18)19/h4-7H,3,15H2,1-2H3

InChI Key:

CXRJNUVDWUINBY-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c(N)sc(c1C)c1ccc(cc1)[N+](=O)[O-]

Complexity:

393

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

306.067g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

306.336g/mol

Monoisotopic Mass:

306.067g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

126A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.9