N,N'-Dibutylurea - CAS 1792-17-2

Name: N,N'-Dibutylurea
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB013550
Product Name:	N,N'-Dibutylurea
CAS:	1792-17-2
Synonyms:	1,3-dibutylurea; 1,3-dibutylurea

Technical Data

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Computed Properties

IUPAC Name:	1,3-dibutylurea
Description:	N,N'-Dibutylurea (CAS# 1792-17-2) is a degradation product of Benomyl, the active ingredient in Benlate fungicides.
Molecular Weight:	172.27
Molecular Formula:	C9H20N2O
Canonical SMILES:	CCCCNC(=O)NCCCC
InChI:	InChI=1S/C9H20N2O/c1-3-5-7-10-9(12)11-8-6-4-2/h3-8H2,1-2H3,(H2,10,11,12)
InChI Key:	AQSQFWLMFCKKMG-UHFFFAOYSA-N
Boiling Point:	115 °C / 0.03 mmHg, 310.9 °C at 760 mmHg
Density:	0.897 g/cm³
MDL:	MFCD00015229
LogP:	2.66760

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]C9H8O2
Oxiran-2-yl(phenyl)methanone
[87-88-7]C6H2Cl2O4
Chloranilic acid
[17746-05-3]C11H21ClO
Undecanoyl chloride
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea

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Publication Number	Title	Priority Date
AU-2020102849-A4	Method for directly synthesizing N, N'-dialkyl urea and derivatives thereof by using one-step visible-light CO2 catalysis method	20201019
CN-214299948-U	A recovery unit that is arranged in dibutyl urea waste water to go to	20200921
WO-2021154676-A1	Methods of preparing a catalyst utilizing hydrated reagents	20200128
JP-2021113157-A	Method for producing alkylurea compound	20200116
KR-102290191-B1	Abrasive slurry composition for sti cmp and method for preparing thereof	20191206

PMID	Publication Date	Title	Journal
22190125	20120204	A phosphine-free Pd catalyst for the selective double carbonylation of aryl iodides	Chemical communications (Cambridge, England)
22026535	20111202	Base-controlled selective conversion of Michael adducts of malonates with enones in the presence of iodine	The Journal of organic chemistry
21069235	20110121	DBU-catalyzed transprotection of N-Fmoc-cysteine di- and tripeptides into S-Fm-cysteine di- and tripeptides	Organic & biomolecular chemistry
20485817	20100721	Intramolecular Michael addition reaction for the synthesis of benzylbutyrolactones	Organic & biomolecular chemistry
18429618	20080515	Synthesis of 5-vinylideneoxazolidin-2-ones by DBU-mediated CO2-fixation reaction of 4-(benzylamino)-2-butynyl carbonates and benzoates	Organic letters

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.157563266
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	172.157563266
Rotatable Bond Count:	6
Topological Polar Surface Area:	41.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2