N,N'-DI(TERT-BUTYL)UREA

CAS

5336-24-3

Catalog Number

ACM5336243

Category

Other Products

Molecular Weight

172.27

Molecular Formula

C9H20N2O

MSDS COA Spec Sheet

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Specification

Synonyms

1,3-Di-tert-butylurea, 1,3-ditert-butylurea, Urea, N,N-bis(1,1-dimethylethyl)-, Urea, 1,3-di-tert-butyl-, 5336-24-3, Di-tert-Butylurea, NSC1052, 1,3-ditert-butyl-urea, Urea,3-di-tert-butyl-, AC1L2IAD, AC1Q1MMU, N,N-Di-tert-butylurea, N,N-di(tert-butyl)urea, CTK1G9606, N,N-Bis(1,1-dimethylethyl)urea, NSC-1052, Urea,N-bis(1,1-dimethylethyl)-, ZINC00160323, AG-B-30729, MCULE-8965745506

IUPAC Name

1,3-ditert-butylurea

Canonical SMILES

CC(C)(C)NC(=O)NC(C)(C)C

InChI Key

WSABLXKFAPKFSO-UHFFFAOYSA-N

Boiling Point

284.6ºC at 760 mmHg

Flash Point

109.1ºC

Density

0.897g/cm³

Exact Mass

172.15800

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

7188-38-7
75-64-9

691-24-7
5336-24-3

Reference: [1]Liu, Bifu; Yin, Meizhou; Gao, Hanling; Wu, Wanqing; Jiang, Huanfeng
[Journal of Organic Chemistry, 2013, vol. 78, # 7, p. 3009 - 3020]
[2]Pri-Bar, Ilan; Schwartz, Jeffrey
[Chemical Communications, 1997, # 4, p. 347 - 348]

Downstream Synthesis Route 1

5336-24-3
67901-82-0

133497-47-9

Reference: [1]Journal of Medicinal Chemistry,1991,vol. 34,p. 2004 - 2013

Downstream Synthesis Route 2

5336-24-3

691-24-7

Reference: [1]Schlama; Gouverneur; Mioskowski
[Tetrahedron Letters, 1996, vol. 37, # 39, p. 7047 - 7048]
[2]Jaszay, Zsuzsa M.; Petnehazy, Imre; Toeke, Laszlo; Szajani, Bela
[Synthesis, 1987, # 5, p. 520 - 523]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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