CAS 538-93-2|Isobutylbenzene

Introduction：Basic information about CAS 538-93-2|Isobutylbenzene, 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	Isobutylbenzene
CAS Number	538-93-2	Molecular Weight	134.218
Density	0.9±0.1 g/cm3	Boiling Point	175.4±7.0 °C at 760 mmHg
Molecular Formula	C₁₀H₁₄	Melting Point	−51 °C(lit.)
MSDS	ChineseUSA	Flash Point	49.9±8.5 °C
Symbol	GHS02, GHS07	Signal Word	Warning

Names

Name	isobutylbenzene
Synonym	More Synonyms

Chemical & Physical Properties

Density	0.9±0.1 g/cm3
Boiling Point	175.4±7.0 °C at 760 mmHg
Melting Point	−51 °C(lit.)
Molecular Formula	C₁₀H₁₄
Molecular Weight	134.218
Flash Point	49.9±8.5 °C
Exact Mass	134.109543
LogP	4.09
Vapour Pressure	1.5±0.2 mmHg at 25°C
Index of Refraction	1.490
Water Solubility	INSOLUBLE

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DA3550000

CHEMICAL NAME :: Benzene, isobutyl-

CAS REGISTRY NUMBER :: 538-93-2

BEILSTEIN REFERENCE NO. :: 1852218

LAST UPDATED :: 199710

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C10-H14

MOLECULAR WEIGHT :: 134.24

WISWESSER LINE NOTATION :: 1Y1&1R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 5 gm/kg

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

REFERENCE :: 28ZRAQ "Toxicology and Biochemistry of Aromatic Hydrocarbons," Gerarde, H., New York, Elsevier, 1960 Volume(issue)/page/year: -,56,1960

Safety Information

Symbol	GHS02, GHS07
Signal Word	Warning
Hazard Statements	H226-H315-H319-H335
Precautionary Statements	P261-P305 + P351 + P338
Personal Protective Equipment	Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Hazard Codes	Xi:Irritant;
Risk Phrases	R10;R36/37/38
Safety Phrases	S26-S36-S61-S60
RIDADR	UN 3295 3/PG 3
WGK Germany	3
RTECS	DA3550000
Packaging Group	III
Hazard Class	3
HS Code	2902909090

Customs

HS Code	2902909090
Summary	2902909090 other aromatic hydrocarbons。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:2.0%。General tariff:30.0%

Articles2

Evaluation of injection methods for fast, high peak capacity separations with low thermal mass gas chromatography.

J. Chromatogr. A. 1392 , 82-90, (2015)

Low thermal mass gas chromatography (LTM-GC) was evaluated for rapid, high peak capacity separations with three injection methods: liquid, headspace solid phase micro-extraction (HS-SPME), and direct ...

Decoys for docking.

J. Med. Chem. 48 , 3714-28, (2005)

Molecular docking is widely used to predict novel lead compounds for drug discovery. Success depends on the quality of the docking scoring function, among other factors. An imperfect scoring function ...

Synonyms

2-Methyl-1-phenylpropane

1Y1&1R

EINECS 208-706-2

lithium propan-2-ide

Isopropyllithium

Lithium Propane

iso-butyl benzene

Isobutylbenzene

i-propylmethylbenzene

Isopropyllithium solution

MFCD00008936

Benzene, (2-methylpropyl)-

benzene, isobutyl-

(2-Methylpropyl)benzene

isobutyl-benzene

4-isopropylmethylbenzene

i-propyllithium

4-isobutyl-benzene

ISO-BUTYLBENZENE

propen-2-yl lithium

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