EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

hexane nitrile
capronitrile

Supplier Sponsors

CAS Number: 628-73-9Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:211-052-0
FDA UNII: S1XKP5498P
Nikkaji Web:J6.881K
Beilstein Number:1633601
MDL:MFCD00001979
XlogP3:1.70 (est)
Molecular Weight:97.16067000
Formula:C6 H11 N
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.80600 to 0.81000 @ 20.00 °C.
Pounds per Gallon - (est).: 6.715 to 6.748
Refractive Index:1.40500 to 1.40900 @ 20.00 °C.
Melting Point: 163.00 to 164.00 °C. @ 760.00 mm Hg
Boiling Point: 163.60 °C. @ 760.00 mm Hg
Vapor Pressure:1.961000 mmHg @ 25.00 °C. (est)
Flash Point: 110.00 °F. TCC ( 43.00 °C. )
logP (o/w): 1.660
Soluble in:
 alcohol
 water, 2475 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Santa Cruz Biotechnology
For experimental / research use only.
Hexanenitrile
Sigma-Aldrich: Aldrich
For experimental / research use only.
Hexanenitrile 98%
TCI AMERICA
For experimental / research use only.
Hexanenitrile >97.0%(GC)
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xn - Harmful.
R 10 - Flammable.
R 22 - Harmful if swallowed.
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
S 20/21 - When using do not eat, drink or smoke.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37 - Wear suitable protective clothing and gloves.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-mouse LD50 463 mg/kg
Nippon Eiseigaku Zasshi. Japanese Journal of Hygiene. Vol. 39, Pg. 423, 1984.

intravenous-rabbit LDLo 42 mg/kg
Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 153, Pg. 895, 1911.

Dermal Toxicity:
subcutaneous-guinea pig LDLo 310 mg/kg
Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 153, Pg. 895, 1911.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for hexane nitrile usage levels up to:
  0.0100 % in the fragrance concentrate.
 
Recommendation for hexane nitrile flavor usage levels up to:
 not for flavor use.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):628-73-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :12352
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1993
WGK Germany:3
hexanenitrile
Chemidplus:0000628739
RTECS:MO3900000 for cas# 628-73-9
 
References:
 hexanenitrile
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):12352
Pubchem (sid):134976023
Pherobase:View
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
FooDB:FDB014346
Export Tariff Code:2926.90.5050
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 egg cooked egg
Search PMC Picture
 kohlrabi stem
Search Trop Picture
 
Synonyms:
 capronitrile
N-capronitrile
1-cyanopentane
 hexanenitrile
 hexanonitrile
 pentyl cyanide
 tricapronile
 
 
Notes:
None found
Please share your Comments.
Email Address:
Top of Page Home
Copyright © 1980-2021 The Good Scents Company (tgsc) ™ Disclaimer Privacy Policy