Butanenitrile, 4-(phenylamino)- (9CI)

Modify Date: 2025-08-27 09:49:58

Butanenitrile, 4-(phenylamino)- (9CI) Structure
Butanenitrile, 4-(phenylamino)- (9CI) structure
Common Name Butanenitrile, 4-(phenylamino)- (9CI)
CAS Number 73747-25-8 Molecular Weight 160.21600
Density 1.055g/cm3 Boiling Point 344.5ºC at 760 mmHg
Molecular Formula C10H12N2 Melting Point N/A
MSDS N/A Flash Point 162.1ºC

 Names

Name 4-anilinobutanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.055g/cm3
Boiling Point 344.5ºC at 760 mmHg
Molecular Formula C10H12N2
Molecular Weight 160.21600
Flash Point 162.1ºC
Exact Mass 160.10000
PSA 35.82000
LogP 2.47528
Index of Refraction 1.568
InChIKey QMBPIQSHYXCCMR-UHFFFAOYSA-N
SMILES N#CCCCNc1ccccc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ET8850000
CHEMICAL NAME :
Butyronitrile, 4-anilino-
CAS REGISTRY NUMBER :
73747-25-8
BEILSTEIN REFERENCE NO. :
3240602
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H12-N2
MOLECULAR WEIGHT :
160.24
WISWESSER LINE NOTATION :
NC3MR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03391

 Synthetic Route

~87%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Ikawa, Takashi; Fujita, Yuki; Mizusaki, Tomoteru; Betsuin, Sae; Takamatsu, Haruki; Maegawa, Tomohiro; Monguchi, Yasunari; Sajiki, Hironao Organic and Biomolecular Chemistry, 2012 , vol. 10, # 2 p. 293 - 304

~0%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Wang, Hong-Jun; Keilman, Jeffrey; Pabba, Chittari; Chen, Zhen-Jia; Gregg, Brian T. Tetrahedron Letters, 2005 , vol. 46, # 15 p. 2631 - 2634

~0%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Wang, Hong-Jun; Keilman, Jeffrey; Pabba, Chittari; Chen, Zhen-Jia; Gregg, Brian T. Tetrahedron Letters, 2005 , vol. 46, # 15 p. 2631 - 2634

~76%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Korbonits, Dezsoe; Horvath, Karoly; Goenczi, Csaba; Tamas, Jozsef Acta Chimica Hungarica, 1984 , vol. 117, # 3 p. 239 - 246

~%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Wang, Hong-Jun; Keilman, Jeffrey; Pabba, Chittari; Chen, Zhen-Jia; Gregg, Brian T. Tetrahedron Letters, 2005 , vol. 46, # 15 p. 2631 - 2634

~%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Ikawa, Takashi; Fujita, Yuki; Mizusaki, Tomoteru; Betsuin, Sae; Takamatsu, Haruki; Maegawa, Tomohiro; Monguchi, Yasunari; Sajiki, Hironao Organic and Biomolecular Chemistry, 2012 , vol. 10, # 2 p. 293 - 304

~%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Leonard et al. Journal of the American Chemical Society, 1953 , vol. 75, p. 3727,3730

~47%

Butanenitrile, 4-(phenylamino)- (9CI) Structure

Butanenitrile, ...

CAS#:73747-25-8

Literature: Link, Natalia P.; Diaz, Jimena E.; Orelli, Liliana R. Synlett, 2009 , # 5 p. 751 - 754

 Synonyms

N-(3-cyanopropyl)aniline
4-anilino-butyronitrile
4-(phenylamino)butyronitrile
BUTYRONITRILE,4-ANILINO
4-Anilino-butyronitril
Butanenitrile,4-(phenylamino)
3-Anilinopropyl cyanide
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