4-(Heptyloxy)benzonitrile

Modify Date: 2024-01-08 10:54:09

4-(Heptyloxy)benzonitrile Structure
4-(Heptyloxy)benzonitrile structure
Common Name 4-(Heptyloxy)benzonitrile
CAS Number 29147-88-4 Molecular Weight 217.307
Density 1.0±0.1 g/cm3 Boiling Point 341.3±15.0 °C at 760 mmHg
Molecular Formula C14H19NO Melting Point 210-212°C
MSDS N/A Flash Point 144.1±14.3 °C

 Names

Name 4-heptoxybenzonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.0±0.1 g/cm3
Boiling Point 341.3±15.0 °C at 760 mmHg
Melting Point 210-212°C
Molecular Formula C14H19NO
Molecular Weight 217.307
Flash Point 144.1±14.3 °C
Exact Mass 217.146667
PSA 33.02000
LogP 5.06
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.504

 Safety Information

Hazard Codes Xi
Risk Phrases R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Phrases S26-S37/39
WGK Germany 3
HS Code 2926909090

 Synthetic Route

~75%

4-(Heptyloxy)benzonitrile Structure

4-(Heptyloxy)be...

CAS#:29147-88-4

Literature: RECEPTOS, INC.; BOEHM, Marcus, F.; MARTINBOROUGH, Esther; MOORJANI, Manisha; TAMIYA, Junko; HUANG, Liming; YEAGER, Adam, R.; BRAHMACHARY, Enugurthi; FOWLER, Thomas; NOVAK, Andrew; MEGHANI, Premji; KNAGGS, Michael Patent: WO2013/90454 A2, 2013 ; Location in patent: Paragraph 00249 ;

~85%

4-(Heptyloxy)benzonitrile Structure

4-(Heptyloxy)be...

CAS#:29147-88-4

Literature: Tunoori, Ashok Rao; Dutta, Dinah; Georg, Gunda I. Tetrahedron Letters, 1998 , vol. 39, # 48 p. 8751 - 8754

~73%

4-(Heptyloxy)benzonitrile Structure

4-(Heptyloxy)be...

CAS#:29147-88-4

Literature: Gallardo, H.; Begnini, I. M. Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals, 1995 , vol. 258, p. 85 - 94

 Customs

HS Code 2926909090
Summary HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

4-HEPTYLOXYBENZONITRILE
4-heptyloxybenzenecarbonitrile
4-N-heptyloxybenzonitrile
Benzonitrile,4-(heptyloxy)
4-(Heptyloxy)benzonitrile
4-n-Heptyloxy-benzonitril
Benzonitrile, 4-(heptyloxy)-
MFCD00143323
4-heptoxybenzenecarbonitrile