4-oxiran-2-ylbenzonitrile

CAS

52695-39-3

Catalog Number

ACM52695393

Category

Other Products

Molecular Weight

145.158 g/mol

Molecular Formula

C9H7NO

MSDS COA Spec Sheet

If you have any other questions or need other size, please get a quote.

Specification

Synonyms

p-Cyanostyrene oxide, 4-Oxiranylbenzonitrile, BENZONITRILE, 4-OXIRANYL-, BRN 1307303, MolPort-004-304-671, CID40494, LS-38771, 5-18-06-00371 (Beilstein Handbook Reference), 52695-39-3

IUPAC Name

4-(oxiran-2-yl)benzonitrile

Canonical SMILES

C1C(O1)C2=CC=C(C=C2)C#N

InChI Key

WLNIRLBZLAAEAQ-UHFFFAOYSA-N

Boiling Point

285.7ºC at 760mmHg

Flash Point

120.1ºC

Density

1.2g/cm³

Exact Mass

145.05300

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

20099-89-2

52695-39-3

Reference: [1]Patent: US6291475,2001,B1

Downstream Synthesis Route 1

52695-39-3

3435-51-6

Reference: [1]Mikami, Yusuke; Noujima, Akifumi; Mitsudome, Takato; Mizugaki, Tomoo; Jitsukawa, Koichiro; Kaneda, Kiyotomi
[Tetrahedron Letters, 2010, vol. 51, # 41, p. 5466 - 5468]
[2]Location in patent: experimental part
Mitsudome, Takato; Noujima, Akifumi; Mikami, Yusuke; Mizugaki, Tomoo; Jitsukawa, Koichiro; Kaneda, Kiyotomi
[Chemistry - A European Journal, 2010, vol. 16, # 39, p. 11818 - 11821]
[3]Shiraishi, Yasuhiro; Hirakawa, Hiroaki; Togawa, Yoshiki; Hirai, Takayuki
[ACS Catalysis, 2014, vol. 4, # 6, p. 1642 - 1649]

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

Recommended Products