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폴리부틸렌네글리콜디메타크릴레이트

Butanediol dimethacrylate

HCID 16387
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
2082-81-7
표준 SMILES
C=C(C)C(=O)OCCCCOC(=O)C(=C)C
InChIKey
XOJWAAUYNWGQAU-UHFFFAOYSA-N
분자식
C12H18O4
평균 분자량
226.27 g/mol
단동위원소 질량
226.12050905

이름 및 식별자

우선 이름
Butanediol dimethacrylate
IUPAC
4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate
현지명
폴리부틸렌네글리콜디메타크릴레이트
영어명
Polybutyleneglycol dimethacrylate
분자식
(C4H8O)nC8H10O3
분자량
0

이름 및 동의어

1,4-BUTANEDIOL DIMETHACRYLATE2082-81-72-Propenoic acid, 2-methyl-, 1,4-butanediyl ester1,4-Butylene glycol dimethacrylateButylene dimethacrylate1,4-Butylene dimethacrylateTetramethylene glycol dimethacrylateButanediol dimethacrylateTetramethylene methacrylateKX6732HE0UMethacrylic acid, tetramethylene esterOligotetramethylene glycol dimethacrylate
이름 더 보기
폴리부틸렌네글리콜디메타크릴레이트Polybutyleneglycol dimethacrylatePOLYBUTANEDIOL 600 DIMETHACRYLATEPOLYBUTANEDIOL 2000 DIMETHACRYLATEPolytetramethyleneglycoldimethacrylatePOLYTETRAMETHYLENE GLYCOL 600 DIMETHACRYLATEPOLYTETRAMETHYLENE GLYCOL 2000 DIMETHACRYLATEalpha-(2-methyl-1-oxo-2-propenyl)-omega-[(2-methyl-poly(oxy-4-butanediyl)Poly(oxy-1,4-butanediyl), α-(2-methyl-1-oxo-2-propen-1-yl)-ω-[(2-methyl-1-oxo-2-propen-1-yl)oxy]-4-butanediyl),.alpha.-(2-methyl-1-oxo-2-propenyl)-.omega.-[(2-methyl-1-oxo-2-propenyl)oxy]-Poly(oxy-1
X 970butanediyl dimethacrylateRefChem:731581,4-BDMA218-218-1Tetramethylene dimethacrylateButane-1,4-diyl bis(2-methylacrylate)4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate

데이터베이스 식별자

CAS
2082-81-7、28883-57-0
PubChem CID
16387
DTXSID
DTXSID4044870
ChEMBL
CHEMBL3184875
UNII
KX6732HE0U
EC Number
218-218-1
Nikkaji
J112.782I

물성

구조 계산 물성

XLogP
3.2
극성 표면적
52.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
9
무거운 원자 수
16
형식 전하
0
복잡도
261

실험 및 물리화학적 성질

PolymersPlastics & Rubber -> (Meth)acrylates
Density1.011 @ 25 °C/15.6 °C
Color/FormLiquid
Boiling Point110 °C @ 3 MM HG
Polymerization · 1건

METHYL METHACRYLATE, AND IN GENERAL THE METHACRYLIC ESTERS, POLYMERIZE MUCH LESS READILY THAN THE CORRESPONDING ORDINARY ACRYLATES. NONE THE LESS, THEY ARE STABILIZED BY ADDING HYDROQUINONE OR PYROGALLOL, PARTICULARLY IN THE PRESENCE OF METALLIC COPPER. /METHACRYLATES/

Food Contact Substances · 3건

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications

FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications

Refractive Index · 2건

INDEX OF REFRACTION: 1.4502 @ 25 °C

Index of refraction: 1.4872 at 20 °C/D

Physical Description · 2건

Liquid; CBI; Wet Solid

Liquid; [HSDB] Colorless liquid; [Aldrich MSDS]

물리화학적 성질

Specific Gravity
0.998 · 0.998
InChI
InChI=1S/C12H18O4/c1-9(2)11(13)15-7-5-6-8-16-12(14)10(3)4/h1,3,5-8H2,2,4H3
InChIKey
XOJWAAUYNWGQAU-UHFFFAOYSA-N
SMILES
C(=O)(C(=C)C)O{-}CCCC{+n}OC(=O)C(=C)C
EPA
Poly(oxy-1,4-butanediyl), .alpha.-(2-methyl-1-oxo-2-propenyl)-.omega.-[(2-methyl-1-oxo-2-propenyl)oxy]- (28883-57-0)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 6건

Warning

H317: May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

This chemical does not meet GHS hazard criteria for 7% (24 of 341) of reports.

Warning

H315 (59.5%): Causes skin irritation [Warning Skin corrosion/irritation]

유해성 정보

Regulatory Information · 6건

Chemical: Poly(oxy-1,4-butanediyl), .alpha.-(2-methyl-1-oxo-2-propen-1-yl)-.omega.-[(2-methyl-1-oxo-2-propen-1-yl)oxy]-

Chemical: 2-Propenoic acid, 2-methyl-, 1,4-butanediyl ester

2-Propenoic acid, 2-methyl-, 1,1'-(1,4-butanediyl) ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 2-Propenoic acid, 2-methyl-, 1,1'-(1,4-butanediyl) ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used.

REACH registered substance: Tetramethylene dimethacrylate (EC: 218-218-1)

2-Propenoic acid, 2-methyl-, 1,4-butanediyl ester: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryAllergic contact dermatitis reported in dental technicians; [Kanerva, p. 1739] Stabilized with 100 ppm of p-methoxyphenol; [ChemIDplus] An irritant and lachrymator; May cause skin sensitization; [Aldrich MSDS]
TSCA RequirementsSection 8(a) of TSCA requires manufacturers of this chemical substance to report preliminary assessment information concerned with production, use, and exposure to EPA as cited in the preamble of the 51 FR 41329.
Hazard Classes and Categories · 3건

Skin Irrit. 2 (59.5%)

Skin sensitization - Category 1B

Skin Sens. 1B

Skin, Eye, and Respiratory IrritationsMethacrylates ... produce slight to moderate skin and eye irritation ... depending upon volatility, these materials also may be sensory irritants. /Methacrylic acid & derivatives/

안전 및 보호

Storage Conditions · 1건

Temp during storage must be kept low to minimize formation of peroxides and other oxidation products. ... Storage temp below 30 °C are recommended for the polyfunctional methacrylates. ... The methacrylate monomers should not be stored for longer than one year. Shorter storage times are recommended for the aminomethacrylates, ie, three months, and the polyfunctional methacrylates, ie, six months. Many of these cmpd are sensitive to UV light and should, therefore, be stored in the dark. The methacrylic esters may be stored in mild steel, stainless steel, or aluminum. /Methacrylic acid & derivatives/

Preventive Measures · 3건

... Hazard is the generation of considerable exothermic heat in some of the reactions, so that high pressures & temp may develop. This danger ... should be borne in mind when designing plant. Awareness of the dangers and of good engineering design are essential to safety. Employees should be instructed about the necessity of cleansing the skin if it is contaminated by materials which are irritants or skin-absorbed. With careful design, however, and complete enclosure of those processes where toxic chemicals or intermediates occur, dangerous exposures can be avoided. /Acrylic acid & derivatives/

SRP: Contaminated protective clothing should be segregated in such a manner so that there is no direct personal contact by personnel who handle, dispose, or clean the clothing. Quality assurance to ascertain the completeness of the cleaning procedures should be implemented before the decontaminated protective clothing is returned for reuse by the workers. Contaminated clothing should not be taken home at end of shift, but should remain at employee's place of work for cleaning.

SRP: The scientific literature for the use of contact lenses in industry is conflicting. The benefit or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.

Personal Protective Equipment (PPE)SUITABLE PROTECTIVE CLOTHING & SELF-CONTAINED RESP PROTECTIVE APPARATUS SHOULD BE AVAILABLE FOR USE OF THOSE WHO MAY HAVE TO RESCUE PERSONS OVERCOME BY FUMES. /ACRYLIC ACID & DERIVATIVES/

독성 정보

Adverse EffectsLacrimator (Lachrymator) - A substance that irritates the eyes and induces the flow of tears.
Human Toxicity Excerpts · 1건

BIOLOGICALLY, METHACRYLATES RESEMBLE ACRYLATES, EXCEPT FOR LOWER REACTIVITY & THUS DECR TOXICITY. THIS IS PROBABLY DUE TO STERIC HINDRANCE BY ITS METHYL GROUP & IN TURN DECR RATES OF MEMBRANE TRANSPORT & SYSTEMIC TRANSLOCATION. /METHACRYLIC ESTERS/

규제 정보

TSCA RequirementsSection 8(a) of TSCA requires manufacturers of this chemical substance to report preliminary assessment information concerned with production, use, and exposure to EPA as cited in the preamble of the 51 FR 41329.

안전 데이터

tsca
TSCA listed

화학 및 산업

약리 정보

Metabolism/MetabolitesSMALL QUANTITIES OF METHACRYLATES MAY READILY BE METABOLIZED BY SAPONIFICATION INTO THE ALCOHOL AND METHACRYLIC ACID. THE LATTER MAY FORM AN ACETYL-COENZYME A DERIVATIVE, WHICH THEN ENTERS THE NORMAL LIPID METABOLISM. /METHACRYLATES/

용도 및 제조

Uses · 5건

Used as a monomer for resins and crosslinking agent for UV curable coatings and polymer used in contact lenses; [HSDB]

Plastic Composites Manufacturing [Category: Industry]

MONOMER FOR RESINS.

CROSSLINKING AGENT FOR POLYMER USED IN CONTACT LENSES.

CROSSLINKING AGENT FOR UV CURABLE COATINGS.

U.S. Production2023: 1,000,000 - <2,500,000 lb
Consumer UsesMonomers
Industry UsesAdhesion/cohesion promoter
Methods of Manufacturing · 2건

The methacrylates can be synthesized by catalytic oxidation of isobutylene and subsequent esterification with the appropriate alcohol, or by reacting acetone with hydrocyanic acid and subsequent esterification in sulfuric acid with the appropriate alcohol. /Methacrylic esters/

TRANSESTERIFICATION OR ESTERIFICATION OF 1,4-BUTANEDIOL WITH EITHER METHYL METHACRYLATE OR METHACRYLIC ACID.

General Manufacturing Information · 4건

Miscellaneous Manufacturing

2-Propenoic acid, 2-methyl-, 1,1'-(1,4-butanediyl) ester: ACTIVE

Poly(oxy-1,4-butanediyl), .alpha.-(2-methyl-1-oxo-2-propen-1-yl)-.omega.-[(2-methyl-1-oxo-2-propen-1-yl)oxy]-: ACTIVE

METHYL METHACRYLATE, AND IN GENERAL THE METHACRYLIC ESTERS, POLYMERIZE MUCH LESS READILY THAN THE CORRESPONDING ORDINARY ACRYLATES. NONE THE LESS, THEY ARE STABILIZED BY ADDING HYDROQUINONE OR PYROGALLOL, PARTICULARLY IN THE PRESENCE OF METALLIC COPPER. /METHACRYLATES/

응용 분야

용도POLYBUTYLENE GLYCOL DIMETHACRYLATE is a material intermediate used in the manufacture of resins, coatings and contact lens materials, amongst other applications.

공급사100 곳

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