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(2-Methylallyloxy)benzene

HCID 79893
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
5820-22-4
Standard SMILES
C=C(C)COc1ccccc1
InChIKey
LECDNXOCIPRJNJ-UHFFFAOYSA-N
Molecular formula
C10H12O
Average molar mass
148.2 g/mol
Monoisotopic mass
148.088815

Names & identifiers

Preferred name
(2-Methylallyloxy)benzene
IUPAC
2-methylprop-2-enoxybenzene
English name
Methallyl phenyl ether
Molecular formula
C10H12O
Molecular weight
148.2

Names & synonyms

5820-22-4[(2-methylprop-2-en-1-yl)oxy]benzene(2-Methylallyloxy)benzeneBenzene, [(2-methyl-2-propenyl)oxy]-EINECS 227-393-3[(2-methyl-2-propen-1-yl)oxy]BenzeneAI3-02108DTXSID40206948[2-(2-methylpropenyl)] phenyl etherNSC 403849Benzene, ((2-methyl-2-propenyl)oxy)-(2-(2-methylpropenyl)) phenyl ether
Show more names
Methallylphenylether,96%2-Methylallyl phenyl etherPhenyl(2-methylallyl) ether2-methylprop-2-enoxybenzeneEther, 2-methylallyl phenyl2-METHYL-2-PROPENYL PHENYL ETHER[(2-Methyl-2-propenyl)oxy]benzene
((2-methylprop-2-en-1-yl)oxy)benzene((2-Methyl-2-propen-1-yl)oxy)benzeneRefChem:396102DTXCID70129439227-393-3InChI=1/C10H12O/c1-9(2)8-11-10-6-4-3-5-7-10/h3-7H,1,8H2,2HMethallyl phenyl etherMETHALLYLPHENYLETHER

Database identifiers

CAS
5820-22-4
PubChem CID
79893
DTXSID
DTXSID40206948
UNII
HJF95CK6LG
EC Number
227-393-3
Nikkaji
J103.240B

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
123

Physicochemical properties

Melting point
-33.2 °C · -33.2°C
Boiling point
175 · 175-176 °C(lit.)
Density
0.964 g/mL · 0.964 g/mL at 25 °C(lit.)
vapor density
5.1 · 5.1 (vs air)
refractive index
20 · n20/D 1.514(lit.)
Flash point
150 °F · 150 °F
BRN
1933868 · 1933868
FDA UNII
95 CK6LG · HJF95CK6LG
Symbol(GHS)
8 · GHS08
Hazard statements
227 · H227-H317-H334
Precautionary statements
260 · P260-P262-P280g
Hazard Codes
Xn
Risk Statements
36 · 36/37/38-42/43
Safety Statements
26 · 26-36/37/39
RIDADR
3271 · 3271
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H315 (90.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P233, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (90.7%)

Safety data

wgk
3
ridadr
3271
risk_code
36/37/38-42/43
Symbol(GHS)
GHS08
hazard_code
Xn
safety_code
26-36/37/39
Hazard statements
H227-H317-H334
Precautionary statements
P260-P262-P280g

Chemistry & industry

Applications

UsesMethyl allyl phenyl ether is used as a polymerization initiator for plastics and resins.

Upstream & downstream products

Downstream products

3-(2-Acetoxyphenyl)-2-methyl-1-propene

Suppliers14 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
Aladdin Scientific[email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Mainchem Co., Ltd.+86-86-05926210733 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

6 records
New reaction record
HRID 376930 reaction equation
HRID 376930As reactantuspto-grants-2000_02
HRID 825328 reaction equation
HRID 825328As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 1060369 reaction equation
HRID 1060369As reactantuspto-grants-2003_02
HRID 1270634 reaction equation
HRID 1270634As reactantuspto-grants-2007_04
HRID 2302171 reaction equation
HRID 2302171As reactantuspto-grants-2002_08
HRID 2415326 reaction equation
HRID 2415326As reactantuspto-grants-2004_11

Compound notes

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