기본 정보
- CAS
181213-09-2- 표준 SMILES
CCCCCCCCC(=O)Oc1ccccc1S(=O)(=O)[O-].[Na+]- InChIKey
QSKQNALVHFTOQX-UHFFFAOYSA-M- 분자식
- C15H21NaO5S
- 평균 분자량
- 336.4 g/mol
- 단동위원소 질량
- 336.10073905
이름 및 식별자
- 우선 이름
- Sodium 2-(nonanoyloxy)benzenesulfonate
- IUPAC
- sodium 2-nonanoyloxybenzenesulfonate
- 현지명
- 소듐페닐노나노에이트설포네이트
- 영어명
- Nonanoic acid, sulfophenyl ester, sodium salt
- 분자식
- C15H21O5S.Na
- 분자량
- 337.39
이름 및 동의어
Sodium 2-(nonanoyloxy)benzenesulfonate91125-43-8Sulfophenyl nonanoate sodium saltEinecs 434-360-9UNII-936T1MP46X181213-09-2936T1MP46XNonanoic acid, 2-sulfophenyl ester, sodium saltNonanoic acid, sulfophenyl ester, sodium salt (1:1)DTXSID20891952EC 434-360-9RefChem:183594
이름 더 보기
소듐페닐노나노에이트설포네이트노난산,설포페닐에스테르,나트륨염sodium nonanoyloxybenzenenonanoic acid sulfophenyl estersodium nonanoyloxybenzene sulfonate(nobs)
DTXCID109825434-360-9618-704-7Nonanoic acid, sulfophenyl ester, sodium saltNonanoic acid, 2-sulfophenyl ester, sodium salt (1:1)sodium;2-nonanoyloxybenzenesulfonateSCHEMBL179746SCHEMBL29375880
데이터베이스 식별자
- CAS
181213-09-2、91125-43-8- PubChem CID
- 23665774
- DTXSID
DTXSID20891952- UNII
- 936T1MP46X
- EC Number
- 434-360-9、618-704-7
물성
구조 계산 물성
- 극성 표면적
- 91.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 10
- 무거운 원자 수
- 22
- 형식 전하
- 0
- 복잡도
- 405
물리화학적 성질
- 화장품 원료 기능
- 계면활성제 - 세정세척제
- EPA
- Sulfophenyl nonanoate sodium salt (91125-43-8)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264+P265, P272, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Danger
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P264+P265, P272, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
유해성 정보
Regulatory Information
Nonanoic acid, sulfophenyl ester, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Nonanoic acid, sulfophenyl ester, sodium salt (1:1) 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)
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 15-12-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/12974
Nonanoic acid, sulfophenyl ester, sodium salt: 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.
EPA Safer ChemicalChemical: Nonanoic acid, sulfophenyl ester, sodium salt (1:1)
Hazard Classes and Categories
Skin Sens. 1 (100%)
Skin Sens. 1 (100%)
Eye damage - category 1
Eye Dam. 1
안전 데이터
- tsca
- TSCA listed
- 기존화학 물질
- 2000-3-1642
화학 및 산업
용도 및 제조
U.S. Production2023: <50,000 lb
Household ProductsInformation on 16 consumer products that contain Sodium 2-(nonanoyloxy)benzenesulfonate in the following categories is provided:
Use Classification
EPA Safer Chemical Functional Use Classes -> Surfactants
Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern
General Manufacturing InformationNonanoic acid, sulfophenyl ester, sodium salt (1:1): ACTIVE
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