N-Benzylurea - CAS 538-32-9
Catalog: |
BB028366 |
Product Name: |
N-Benzylurea |
CAS: |
538-32-9 |
Synonyms: |
benzylurea |
IUPAC Name: | benzylurea |
Description: | N-Benzylurea (CAS# 538-32-9) is a useful research chemical. |
Molecular Weight: | 150.17? |
Molecular Formula: | C8H10N2O |
Canonical SMILES: | C1=CC=C(C=C1)CNC(=O)N |
InChI: | InChI=1S/C8H10N2O/c9-8(11)10-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10,11) |
InChI Key: | RJNJWHFSKNJCTB-UHFFFAOYSA-N |
Boiling Point: | 282.9 °C at 760 mmHg |
Melting Point: | 149-151 °C |
Purity: | 95 % |
Density: | 1.138 g/cm3 |
Appearance: | White to off-white powder |
MDL: | MFCD00007951 |
LogP: | 1.94610 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021117662-A1 | Cellulose nanocrystal dispersion liquid and cellulose nanocrystal-containing coating liquid | 20191209 |
WO-2021107079-A1 | Method for producing laminate | 20191129 |
WO-2021107146-A1 | Fibrous cellulose, fibrous cellulose dispersion, and sheet | 20191129 |
WO-2021107147-A1 | Fibrous cellulose, fibrous cellulose dispersion, and sheet | 20191129 |
WO-2021107148-A1 | Dispersion liquid | 20191129 |
PMID | Publication Date | Title | Journal |
31055147 | 20190715 | Synthesis and Structure-Activity relationship of 1-(5-isoquinolinesulfonyl)piperazine analogues as inhibitors\xa0of\xa0Mycobacterium tuberculosis IMPDH | European journal of medicinal chemistry |
21604792 | 20110617 | Synthesis of unsymmetrical diarylureas via Pd-catalyzed C-N cross-coupling reactions | Organic letters |
20846089 | 20110601 | Use of Quantitative Structure-Activity Relationship (QSAR) and ADMET prediction studies as screening methods for design of benzyl urea derivatives for anti-cancer activity | Journal of enzyme inhibition and medicinal chemistry |
21430961 | 20110101 | A review on phytochemical and pharmacological investigations of miswak (Salvadora persica Linn) | Journal of pharmacy & bioallied sciences |
20478354 | 20100801 | Phenyl- and benzylurea cytokinins as competitive inhibitors of cytokinin oxidase/dehydrogenase: a structural study | Biochimie |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 150.079312947 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 150.079312947 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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