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111-80-8

111-80-8 structure
111-80-8 structure
Name methyl non-2-ynoate
Synonyms 2-Nonynoic acid, methyl ester
Methyl 2-nonynoate
MFCD00009547
EINECS 203-909-2
methyl non-2-ynoate
2-Nonynoic Acid Methyl Ester
Density 0.9±0.1 g/cm3
Boiling Point 233.1±0.0 °C at 760 mmHg
Molecular Formula C10H16O2
Molecular Weight 168.233
Flash Point 100.6±0.0 °C
Exact Mass 168.115036
PSA 26.30000
LogP 4.09
Vapour Pressure 0.1±0.4 mmHg at 25°C
Index of Refraction 1.447
Storage condition 2-8°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RB3450000
CHEMICAL NAME :
2-Nonynoic acid, methyl ester
CAS REGISTRY NUMBER :
111-80-8
BEILSTEIN REFERENCE NO. :
1759870
LAST UPDATED :
199712
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C10-H16-O2
MOLECULAR WEIGHT :
168.26
WISWESSER LINE NOTATION :
7UU1VO1

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 :
2220 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: 13,871,1975 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X2528 No. of Facilities: 2055 (estimated) No. of Industries: 4 No. of Occupations: 3 No. of Employees: 18974 (estimated) No. of Female Employees: 15026 (estimated)
Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302
Personal Protective Equipment Eyeshields;Gloves
Hazard Codes Xi:Irritant;
Risk Phrases R36/38
Safety Phrases S26-S36/37/39
RIDADR NONH for all modes of transport
WGK Germany 2
RTECS RB3450000
HS Code 2916190090
629-05-0 structure

629-05-0

79-22-1 structure

79-22-1

~10%

111-80-8 structure

111-80-8

Literature: Trost, Barry M.; Taft, Benjamin R.; Masters, James T.; Lumb, Jean-Philip Journal of the American Chemical Society, 2011 , vol. 133, # 22 p. 8502 - 8505
68113-72-4 structure

68113-72-4

79-22-1 structure

79-22-1

~70%

111-80-8 structure

111-80-8

Literature: Negishi, Ei-ichi; Bagheri, Vahid; Chatterjee, Sugata; Luo, Fen-Tair; Miller, Joseph A.; Stoll, A. Timothy Tetrahedron Letters, 1983 , vol. 24, # 47 p. 5181 - 5184
1846-70-4 structure

1846-70-4

74-88-4 structure

74-88-4

~%

111-80-8 structure

111-80-8

Literature: European Journal of Organic Chemistry, , # 13 p. 2507 - 2511
67-56-1 structure

67-56-1

81438-46-2 structure

81438-46-2

201230-82-2 structure

201230-82-2

~55%

18277-20-8 structure

18277-20-8

Detail
Literature: Journal of Organic Chemistry, , vol. 54, # 8 p. 1831 - 1836
67-56-1 structure

67-56-1

201230-82-2 structure

201230-82-2

110296-07-6 structure

110296-07-6

~37%

18277-20-8 structure

18277-20-8

Detail
Literature: Journal of Organic Chemistry, , vol. 52, # 22 p. 4859 - 4863
629-05-0 structure

629-05-0

~%

111-80-8 structure

111-80-8

Literature: European Journal of Organic Chemistry, , # 13 p. 2507 - 2511
133188-94-0 structure

133188-94-0

~%

111-80-8 structure

111-80-8

Literature: Synthetic Communications, , vol. 27, # 17 p. 2993 - 3026
67-56-1 structure

67-56-1

1846-70-4 structure

1846-70-4

~%

111-80-8 structure

111-80-8

Literature: Journal of Organic Chemistry, , vol. 19, p. 1580,1587
HS Code 2916190090
Summary 2916190090 unsaturated acyclic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%
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