Name: Name:Benzoic acid, 4-amino-3-butoxy-
Brand: Angene
SKU: AG002N9L
Rating: 90 (10 reviews)

Benzoic acid, 4-amino-3-butoxy-

CAS No.:

23442-22-0

Catalog Number:

AG002N9L

Molecular Formula:

C11H15NO3

Molecular Weight:

209.2417

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Product Description

Catalog Number:

AG002N9L

Chemical Name:

Benzoic acid, 4-amino-3-butoxy-

CAS Number:

23442-22-0

Molecular Formula:

C11H15NO3

Molecular Weight:

209.2417

MDL Number:

MFCD00869773

IUPAC Name:

4-amino-3-butoxybenzoic acid

InChI:

InChI=1S/C11H15NO3/c1-2-3-6-15-10-7-8(11(13)14)4-5-9(10)12/h4-5,7H,2-3,6,12H2,1H3,(H,13,14)

InChI Key:

HXPQKILUHVHNEE-UHFFFAOYSA-N

SMILES:

CCCCOc1cc(ccc1N)C(=O)O

Properties

Complexity:

208

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

209.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

209.245g/mol

Monoisotopic Mass:

209.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

72.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8

Literature

Title	Journal
Development and validation of a stability-indicating high performance liquid chromatographic assay for benoxinate.	Journal of pharmaceutical and biomedical analysis 20030424