CAS 778-82-5|Ethyl 2-(1H-indol-3-yl)acetate

Introduction：Basic information about CAS 778-82-5|Ethyl 2-(1H-indol-3-yl)acetate, 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. Articles2
7. Synonyms

Common Name	Ethyl 2-(1H-indol-3-yl)acetate
CAS Number	778-82-5	Molecular Weight	203.237
Density	1.2±0.1 g/cm3	Boiling Point	353.4±17.0 °C at 760 mmHg
Molecular Formula	C₁₂H₁₃NO₂	Melting Point	44-45 °C(lit.)
MSDS	ChineseUSA	Flash Point	167.5±20.9 °C

Names

Name	Ethyl 3-indoleacetate
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.2±0.1 g/cm3
Boiling Point	353.4±17.0 °C at 760 mmHg
Melting Point	44-45 °C(lit.)
Molecular Formula	C₁₂H₁₃NO₂
Molecular Weight	203.237
Flash Point	167.5±20.9 °C
Exact Mass	203.094635
PSA	42.09000
LogP	2.42
Vapour Pressure	0.0±0.8 mmHg at 25°C
Index of Refraction	1.607
InChIKey	HUDBDWIQSIGUDI-UHFFFAOYSA-N
SMILES	CCOC(=O)Cc1c[nH]c2ccccc12
Storage condition	-20°C
Water Solubility	insoluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NL3528000

CHEMICAL NAME :: Indole-3-acetic acid, ethyl ester

CAS REGISTRY NUMBER :: 778-82-5

BEILSTEIN REFERENCE NO. :: 0171682

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H13-N-O2

MOLECULAR WEIGHT :: 203.26

WISWESSER LINE NOTATION :: T56 BMJ D1VO2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#06370

Safety Information

Personal Protective Equipment	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes	Xn:Harmful;
Risk Phrases	R21/22;R36/37/38
Safety Phrases	S36/37/39-S26
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	NL3528000
HS Code	2933990090

Customs

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles2

Generation of electronically excited triplet species at the cellular level: a potential source of genotoxicity.

Toxicol. Lett. 67(1-3) , 17-28, (1993)

Selected enzymatic systems can efficiently produce a product in the electronically excited triplet state. Earlier, only the formation of electronically excited singlet species was known. The formation...

Mutants of Nicotiana plumbaginifolia with specific resistance to auxin.

Mol. Gen. Genet. 228(3) , 361-71, (1991)

We have isolated nine independent auxin-resistant mutants of Nicotiana plumbaginifolia by culturing M2 seedlings in the presence of indole-3-acetic acid ethyl ester or 1-naphthaleneacetic acid at conc...

Synonyms

Ethyl 1H-indol-3-ylacetate

ethyl 2-(1H-indol-3-yl)acetate

MFCD00005635

ethyl indole-3-acetate

1H-Indole-3-acetic acid, ethyl ester

EINECS 212-296-0

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