기본 정보
- 표준 SMILES
CCC(C)(C)OOC(C)(C)CC- InChIKey
JJRDRFZYKKFYMO-UHFFFAOYSA-N- 분자식
- C10H22O2
- 평균 분자량
- 174.28 g/mol
- 단동위원소 질량
- 174.16197994
이름 및 식별자
- 우선 이름
- Di-tert-amyl peroxide
- IUPAC
- 2-methyl-2-(2-methylbutan-2-ylperoxy)butane
- 현지명
- 다이-터트-아밀페록사이드
- 영어명
- Di-tert-amyl peroxide
- 분자식
- C10H22O2
- 분자량
- 174.28
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
10508-09-5- PubChem CID
- 25320
- DTXSID
DTXSID9051533- UNII
- T4HBL5JPXK
- EC Number
- 234-042-8
- Nikkaji
- J116.170I
물성
구조 계산 물성
- XLogP
- 3.1
- 극성 표면적
- 18.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 112
실험 및 물리화학적 성질
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications
물리화학적 성질
- 녹는점
- -55 °C · -55°C
- 끓는 점
- 146 °C · 146 °C(lit.)
- 밀도
- 0.818 g/mL · 0.818 g/mL at 25 °C(lit.)
- 증기압
- 14.7 hPa · 14.7hPa at 25℃
- 굴절률
- 20 · n20/D 1.409(lit.)
- 인화점
- 77 °F · 77 °F
- 수용성
- 13.83 mg/L · 13.83mg/L at 20℃
- InChI
- InChI=1S/C10H22O2/c1-7-9(3,4)11-12-10(5,6)8-2/h7-8H2,1-6H3
- InChIKey
- JJRDRFZYKKFYMO-UHFFFAOYSA-N
- SMILES
- O(C(C)(C)CC)OC(C)(C)CC
- LogP
- 4.7 at · 4.7 at 25℃
- NIST
- (CH3)2C(C2H5)OOC(CH3)2C2H5(10508-09-5)
- EPA
- Peroxide, bis(1,1-dimethylpropyl) (10508-09-5)
화학적 성질
Colorless to light yellow liquid
안전 및 규제
GHS 분류
GHS Classification
Danger
H225 (57.7%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P203, P210, P233, P234, P235, P240, P241, P242, P243, P264, P270, P273, P280, P301+P317, P302+P352, P303+P361+P353, P318, P321, P330, P332+P317, P362+P364, P370+P378, P391, P403, P403+P235, P405, P410, P411, P420, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 331 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Peroxide, bis(1,1-dimethylpropyl)
Peroxide, bis(1,1-dimethylpropyl) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Peroxide, bis(1,1-dimethylpropyl) 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)
Status: Active Update: 18-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/15822
Peroxide, bis(1,1-dimethylpropyl): Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- SD8300000
- ridadr
- UN 3107 5.2
- 독성
- mouse,LD50,oral,1450mg/kg (1450mg/kg),"Prehled Prumyslove Toxikologie; Organicke Latky," Marhold, J., Prague, Czechoslovakia, Avicenum, 1986Vol. -, Pg. 263, 1986.
- HS 번호
- 29096000
- risk_code
- 8-22-38-7
- hazard_code
- O,Xn
- safety_code
- 7-16-17-36/37/39-47-14
- 포장분류
- II
- 위험 등급
- 5.2
- 기존화학 물질
- 2009-2-46
화학 및 산업
용도 및 제조
General Manufacturing Information
Plastics Product Manufacturing
Peroxide, bis(1,1-dimethylpropyl): ACTIVE
응용 분야
개요Di-tert-amyl peroxide (DTAP) is a slightly yellowish, mobile liquid. This liquid dialkyl peroxide is used as an initiator (radical source) in the polymerisation of monomers, like e.g. ethylene, styrene, and (meth)acrylates.
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