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140-66-9

140-66-9 structure
140-66-9 structure

Name 4-tert-Octylphenol
Synonyms Phenol, 4-(1,1,3,3-tetramethylbutyl)-
4-(tert-octyl)phenol
4-tert-octyl phenol
Phenol, p- (1,1,3,3-tetramethylbutyl)-
4-(2,4,4-trimethylpentan-2-yl)phenol
EINECS 205-426-2
Phenol, 4- (1,1,3,3-tetramethylbutyl)-
4-(1,1,3,3-TetraMethylbutyl)phenol
p-(Tert-octyl)-Phenol
p-tert-octylphenol
4-(2,4,4-Trimethyl-2-pentanyl)phenol
p-(1,1,3,3-tetramethylbutyl)phenol
MFCD00002368
tert-octylphenol
t-octylphenol
phenol, 4-tert-octyl-
4-tert-octylphenol
para-tert-Octylphenol
Phenol, p-(tert-octyl)-
p-tert octylphenol(PTOP)
Description 4-tert-Octylphenol, a endocrine-disrupting chemical, is an estrogenic drug. 4-tert-Octylphenol induces apoptosis in neuronal progenitor cells in offspring mouse brain. 4-tert-Octylphenol reduces bromodeoxyuridine (BrdU), mitotic marker Ki67, and phospho-histone H3 (p-Histone-H3), resulting in a reduction of neuronal progenitor proliferation. 4-tert-Octylphenol disrupts brain development and behavior in mice[1].
Related Catalog
Target

Human Endogenous Metabolite

References

[1]. Dinh Nam Tran, et al. 4-tert-Octylphenol Exposure Disrupts Brain Development and Subsequent Motor, Cognition, Social, and Behavioral Functions. Oxidative Medicine and Cellular Longevity, 2020.

Density 0.9±0.1 g/cm3
Boiling Point 282.3±0.0 °C at 760 mmHg
Melting Point 79-82 °C(lit.)
Molecular Formula C14H22O
Molecular Weight 206.324
Flash Point 148.3±8.2 °C
Exact Mass 206.167068
PSA 20.23000
LogP 4.93
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.501
Storage condition Refrigerator
Stability Stable. Incompatible with strong oxidizing agents, strong bases.

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SM9625000
CHEMICAL NAME :
Phenol, p-(1,1,3,3-tetramethylbutyl)-
CAS REGISTRY NUMBER :
140-66-9
BEILSTEIN REFERENCE NO. :
0513992
LAST UPDATED :
199710
DATA ITEMS CITED :
11
MOLECULAR FORMULA :
C14-H22-O
MOLECULAR WEIGHT :
206.36
WISWESSER LINE NOTATION :
QR DX1&1&1X1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,228,1986
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
85JCAE "Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986 Volume(issue)/page/year: -,228,1986 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4600 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Lungs, Thorax, or Respiration - other changes Liver - other changes
REFERENCE :
KCRZAE Kauchuk i Rezina. Crude and Vulcanized Rubber. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.11- 1937- Volume(issue)/page/year: 26(9),28,1967
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3210 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Lungs, Thorax, or Respiration - other changes Liver - other changes
REFERENCE :
KCRZAE Kauchuk i Rezina. Crude and Vulcanized Rubber. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.11- 1937- Volume(issue)/page/year: 26(9),28,1967
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1880 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0527972 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
894 mg/kg/31W-I
TOXIC EFFECTS :
Skin and Appendages - hair
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0527972 ** TUMORIGENIC DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
5280 mg/kg/12W-I
TOXIC EFFECTS :
Tumorigenic - equivocal tumorigenic agent by RTECS criteria Skin and Appendages - tumors
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 19,413,1959 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X1842 No. of Facilities: 516 (estimated) No. of Industries: 6 No. of Occupations: 12 No. of Employees: 15351 (estimated) No. of Female Employees: 736 (estimated)
Symbol GHS02 GHS07
GHS02, GHS07
Signal Word Danger
Hazard Statements H225-H319-H336
Supplemental HS Repeated exposure may cause skin dryness or cracking.
Precautionary Statements P210-P261-P305 + P351 + P338
Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US)
Hazard Codes Xn:Harmful;
Risk Phrases R21;R38;R41
Safety Phrases S26-S36
RIDADR 2430
WGK Germany 2
RTECS SM9625000
Packaging Group III
Hazard Class 8
HS Code 29071300
HS Code 2907139000
Summary 2907139000 3-octylphenol。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。Lowest tariff:5.5%。General tariff:30.0%