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알릴2-메틸부톡시아세테이트

Allyl (2-methylbutoxy)acetate

HCID 106730
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
67634-01-9
표준 SMILES
C=CCOC(=O)COCC(C)CC
InChIKey
GWFJURKHPPFFMD-UHFFFAOYSA-N
분자식
C10H18O3
평균 분자량
186.25 g/mol
단동위원소 질량
186.12559443

이름 및 식별자

우선 이름
Allyl (2-methylbutoxy)acetate
IUPAC
prop-2-enyl 2-(2-methylbutoxy)acetate
현지명
알릴2-메틸부톡시아세테이트
영어명
Allyl (2-methylbutoxy)acetate
분자식
C10H18O3
분자량
186.25

이름 및 동의어

Allyl (2-methylbutoxy)acetate67634-01-9Acetic acid, 2-(2-methylbutoxy)-, 2-propen-1-yl esterEINECS 266-804-0U7648V40M4Acetic acid, 2-(2-methylbutoxy)-, 2-propenyl esterDTXSID00867291RefChem:554772DTXCID50815484266-804-0prop-2-enyl 2-(2-methylbutoxy)acetateallyl 2-(2-methylbutoxy)acetate
이름 더 보기
알릴2-메틸부톡시아세테이트알릴(2-메틸부톡시)아세테이트ALLYL AMYL GLYCOLATEAllyl-(2-methylbutoxy)acetatGLYCOLIC ACID, 2-PENTYLOXY:ALLYL ESTER(2-Methylbutoxy)acetic acid allyl ester(2-methylbutoxy)-aceticaci2-propenylesterAceticacid,(2-methylbutoxy)-,2-propenylester(2-Methylbutyloxy)acetic acid 2-propenyl ester
Acetic acid, (2-methylbutoxy)-, 2-propenyl esterUNII-U7648V40M4SCHEMBL2985485GWFJURKHPPFFMD-UHFFFAOYSA-NAKOS015916688Prop-2-en-1-yl (2-methylbutoxy)acetateNS00011945Q27290782

데이터베이스 식별자

CAS
67634-01-9
PubChem CID
106730
DTXSID
DTXSID00867291
UNII
U7648V40M4
EC Number
266-804-0
Nikkaji
J333.239J

물성

구조 계산 물성

XLogP
2.3
극성 표면적
35.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
8
무거운 원자 수
13
형식 전하
0
복잡도
154

실험 및 물리화학적 성질

FragrancesFragrance Ingredient (Allyl (2-methylbutoxy)acetate) -> IFRA transparency List
Physical DescriptionCBI

물리화학적 성질

끓는 점
239.5 · 239.5±15.0 °C(Predicted)
밀도
0.936 · 0.936±0.06 g/cm3(Predicted)
화장품 원료 기능
향수
LogP
2.553 · 2.553 (est)
EPA
2 · Acetic acid, (2-methylbutoxy)-, 2-propenyl ester (67634-01-9)

안전 및 규제

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

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 0.8% (1 of 129) of reports.

Danger

H302 (99.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P273, P280, P284, P301+P317, P302+P352, P304+P340, P316, P317, P319, P320, P321, P330, P332+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 129 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

유해성 정보

Regulatory Information · 3건

Chemical: Acetic acid, 2-(2-methylbutoxy)-, 2-propenyl ester

Acetic acid, 2-(2-methylbutoxy)-, 2-propen-1-yl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Acetic acid, 2-(2-methylbutoxy)-, 2-propen-1-yl 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)

Allyl (2-methbutoxy)acetate: 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.

Other Safety InformationIMAP assessments - Allyl esters of acetic acid ethers: Human health tier II assessment
Hazard Classes and Categories · 2건

Acute Tox. 4 (99.2%)

Acute toxicity (ingestion) - category 4

안전 데이터

tsca
TSCA listed

화학 및 산업

용도 및 제조

U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesFragrance
Industry UsesFragrance
Household ProductsInformation on 25 consumer products that contain Allyl 2-Methylbutoxyacetate in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing Information · 2건

Soap, Cleaning Compound, and Toilet Preparation Manufacturing

Acetic acid, 2-(2-methylbutoxy)-, 2-propen-1-yl ester: ACTIVE

공급사7 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
BOC Sciences[email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
重庆卡兰医药有限公司[email protected]

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