N-Butylbenzenesulfonamide

Product Information

Molecular Formula:
C10H15NO2S
Molecular Weight:
213.30
Description
N-Butylbenzenesulphonamide N is an antifungal antibiotic produced by Pseudomonas sp. AB2. It has anti-phytopathogenic fungus activity. The ED50 for Pythiurn ultimum, Phytophthora capsici, Rhizoctonia solani and Botrytis cinerea are respectively (㎍/mL) ) 73, 41, 33 and 101.
Synonyms
Benzenesulfonamide, N-butyl-; N-n-Butylbenzenesulfonamide; N-Butylbenzenesulphonamide
IUPAC Name
N-butylbenzenesulfonamide
Canonical SMILES
CCCCNS(=O)(=O)C1=CC=CC=C1
InChI
InChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3
InChI Key
IPRJXAGUEGOFGG-UHFFFAOYSA-N
Boiling Point
314 °C
Melting Point
314 °C (lit.)
Flash Point
118 °C
Purity
> 98.0 % (N)
Density
1.15 g/mL at 25 °C (lit.)
Appearance
Oil
Application
Used in the polymers and textile processing industries; Used as a plasticizer, smelting agent for moulding, and softener; Used mainly as a plasticizer.
Refractive Index
1.52
LogP
3.23670

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P260, P273, P314, and P501
Signal Word
Warning

Computed Properties

XLogP3
2.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
5
Exact Mass
213.08234989 g/mol
Monoisotopic Mass
213.08234989 g/mol
Topological Polar Surface Area
54.6Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
237
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-114163812-A Low-temperature-resistant high-wear-resistance nylon material and preparation method and application thereof 2021-12-20
CN-114163814-A Antistatic long-carbon-chain polyamide composition and preparation method thereof 2021-11-30
CN-114122357-A Lithium salt-coated graphene-doped silicon-carbon composite material and preparation method thereof 2021-11-10
CN-113930068-A Preparation method of hollow glass bead master batch 2021-11-08
CN-113969082-A Automobile interior trim skin material and preparation method and application thereof 2021-11-08
CN-113943461-A Temperature-resistant high-gas-barrier dynamic vulcanization alloy for tire inner liner 2021-11-05
JP-2022009148-A Laminated tube 2021-10-14
CN-113755011-A High-strength nylon and manufacturing method thereof applied to ground leveling support 2021-10-12
CN-113773508-A Polyester/nylon composite material, preparation method and application thereof 2021-08-20
CN-113502050-A Automobile air conditioner pipe material and preparation method thereof 2021-07-29

Literatures

PMID Publication Date Title Journal
27633901 2016-12-01 Screening of endocrine activity of compounds migrating from plastic baby bottles using a multi-receptor panel of in vitro bioassays Toxicology in vitro : an international journal published in association with BIBRA
22824510 2012-12-01 Evaluation of N-butylbenzenesulfonamide (NBBS) neurotoxicity in Sprague-Dawley male rats following 27-day oral exposure Neurotoxicology
22789816 2012-09-01 Characterization of the organic contamination pattern of a hyper-saline ecosystem by rapid screening using gas chromatography coupled to high-resolution time-of-flight mass spectrometry The Science of the total environment
22512478 2012-06-01 A review of animal and human studies for management of benign prostatic hyperplasia with natural products: perspective of new pharmacological agents Inflammation & allergy drug targets
21429230 2011-03-24 Overexpression of the UGT73C6 alters brassinosteroid glucoside formation in Arabidopsis thaliana BMC plant biology
20965230 2011-01-30 The natural compounds atraric acid and N-butylbenzene-sulfonamide as antagonists of the human androgen receptor and inhibitors of prostate cancer cell growth Molecular and cellular endocrinology
21119678 2011-01-01 The genus Actinoallomurus and some of its metabolites The Journal of antibiotics
19771394 2010-12-01 NBBS isolated from Pygeum africanum bark exhibits androgen antagonistic activity, inhibits AR nuclear translocation and prostate cancer cell growth Investigational new drugs
20696466 2010-10-01 Municipal landfill leachates: a significant source for new and emerging pollutants The Science of the total environment
19842066 2010-09-01 Bioactive secondary metabolites from a new terrestrial Streptomyces sp. TN262 Applied biochemistry and biotechnology
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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