5585-39-7

5585-39-7 structure
5585-39-7 structure
  • Name: (E)-3,7-Dimethyl-2,6-octadienenitrile
  • Chemical Name: (E)-3,7-Dimethyl-2,6-octadienenitrile
  • CAS Number: 5585-39-7
  • Molecular Formula: C10H15N
  • Molecular Weight: 149.23300
  • Create Date: 2018-11-22 19:40:06
  • Modify Date: 2024-01-22 21:24:41

Name (E)-3,7-Dimethyl-2,6-octadienenitrile
Synonyms NERAL
cis-Citral
Citral b
3,7-dimethyl-2,6-octadienonitrile
Neroli aldehyde
geranylnitrile
trans-3,7-dimethyl-2,6-octadienenitrile
trans-geranonitrile
Density 0.858g/cm3
Boiling Point 247.9ºC at 760mmHg
Molecular Formula C10H15N
Molecular Weight 149.23300
Flash Point 103.7ºC
Exact Mass 149.12000
PSA 23.79000
LogP 3.20268
Index of Refraction n20/D 1.475(lit.)

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RG5370000
CHEMICAL NAME :
2,6-Octadienenitrile, 3,7-dimethyl-, (E)-
CAS REGISTRY NUMBER :
5585-39-7
LAST UPDATED :
199701
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C10-H15-N
MOLECULAR WEIGHT :
149.26
WISWESSER LINE NOTATION :
NC1UY1&3UY1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,787,1976
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
4300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 14,787,1976 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - E0424 No. of Facilities: 29 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 230 (estimated)
Hazard Codes Xn,N
Risk Phrases 51/53-68
RIDADR UN 3082 9/PG 3
WGK Germany 1