CAS 1745-81-9|2-Allylphenol

Introduction：Basic information about CAS 1745-81-9|2-Allylphenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Articles7
7. Synonyms

Common Name	2-Allylphenol
CAS Number	1745-81-9	Molecular Weight	134.17500
Density	1.028 g/mL at 25 °C(lit.)	Boiling Point	220 °C(lit.)
Molecular Formula	C₉H₁₀O	Melting Point	-6 °C
MSDS	ChineseUSA	Flash Point	192 °F
Symbol	GHS05, GHS06	Signal Word	Danger

Names

Name	2-allylphenol
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.028 g/mL at 25 °C(lit.)
Boiling Point	220 °C(lit.)
Melting Point	-6 °C
Molecular Formula	C₉H₁₀O
Molecular Weight	134.17500
Flash Point	192 °F
Exact Mass	134.07300
PSA	20.23000
LogP	2.12070
Vapour Pressure	0.0783mmHg at 25°C
Index of Refraction	n20/D 1.546(lit.)
InChIKey	QIRNGVVZBINFMX-UHFFFAOYSA-N
SMILES	C=CCc1ccccc1O
Water Solubility	7 g/L (20 ºC)

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SJ3850000

CHEMICAL NAME :: Phenol, o-allyl-

CAS REGISTRY NUMBER :: 1745-81-9

BEILSTEIN REFERENCE NO. :: 0742121

LAST UPDATED :: 199710

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C9-H10-O

MOLECULAR WEIGHT :: 134.19

WISWESSER LINE NOTATION :: QR B2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0536203 ** TUMORIGENIC DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 8400 mg/kg/30W-I

TOXIC EFFECTS :: Tumorigenic - Carcinogenic 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

TYPE OF TEST :: TD - Toxic dose (other than lowest)

ROUTE OF EXPOSURE :: Administration onto the skin

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 3360 mg/kg/12W-I

TOXIC EFFECTS :: Tumorigenic - neoplastic 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

Safety Information

Symbol	GHS05, GHS06
Signal Word	Danger
Hazard Statements	H301 + H311-H314
Precautionary Statements	P280-P301 + P310-P305 + P351 + P338-P310
Personal Protective Equipment	Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	Xi:Irritant;
Risk Phrases	R36/38
Safety Phrases	S26-S36/37/39-S45-S24/25-S23
RIDADR	UN 2923 8/PG 3
WGK Germany	2
RTECS	SJ3850000
Packaging Group	III
Hazard Class	8
HS Code	29071900

Customs

HS Code	29071900

Articles7

Inhibition of rat, mouse, and human glutathione S-transferase by eugenol and its oxidation products.

Chem. Biol. Interact. 99(1-3) , 85-97, (1996)

The irreversible and reversible inhibition of glutathione S-transferases (GSTs) by eugenol was studied in rat, mouse and man. Using liver cytosol of human, rat and mouse, species differences were foun...

Isolation of an unusual metabolite 2-allyloxyphenol from a marine actinobacterium, its biological activities and applications.

Appl. Microbiol. Biotechnol. 86(1) , 109-17, (2010)

A marine actinobacterium isolated from the Bay of Bengal, India and previously found to be producing an antimicrobial and cytotoxic terpenoid was further investigated for antimicrobial metabolites. Th...

Inhibitory effect of bionic fungicide 2-allylphenol on Botrytis cinerea (Pers. ex Fr.) in vitro.

Pest Manag. Sci. 65(12) , 1337-43, (2009)

2-Allylphenol is a registered fungicide in China to control fungal diseases on tomato, strawberry and apple. It is synthetic and structurally resembles the active ingredient ginkgol isolated from Gink...

Synonyms

MFCD00002250

O-ALLYLPHENOL

o-allyl-pheno

ORTHO-ALLYLPHENOL

2-(2-propenyl)-pheno

EINECS 217-119-0

2-ALLYLPHENOL

ALLYLPHENOL-2

allylphenol

Phenol,o-allyl

2-(2-propenyl)phenol

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