염화벤잘코늄
Benzododecinium Chloride
기본 정보
- CAS
139-07-1- 표준 SMILES
CCCCCCCCCCCC[N+](C)(C)Cc1ccccc1.[Cl-]- InChIKey
JBIROUFYLSSYDX-UHFFFAOYSA-M- 분자식
- C21H38N.Cl
- 평균 분자량
- 340 g/mol
개요
Benzododecinium chloride is the organic chloride salt of benzododecinium. It has antiseptic and disinfectant properties, and used as a preservative in eye drop formulations. It has a role as a surfactant, an antiseptic drug, a disinfectant and an antifouling biocide. It is a quaternary ammonium salt and an organic chloride salt. It contains a benzododecinium.
이름 및 식별자
- 우선 이름
- Benzododecinium Chloride
- IUPAC
- benzyl-dodecyl-dimethylazanium chloride
- 현지명
- 염화벤잘코늄
- 영어명
- Dodecyldimethylbenzylammonium chloride
- 분자식
- C21H38ClN
- 분자량
- 339.99
이름 및 동의어
139-07-1N-Benzyl-N,N-dimethyldodecan-1-aminium chlorideBenzododecinium chlorideBenzyldimethyldodecylammonium chlorideCequartyl ABenzyldodecyldimethylammonium chlorideTriton K60Lauryldimethylbenzylammonium chloridedodecyldimethylbenzylammonium chlorideCaswell No. 073ACaswell No. 416CDimethyldodecylbenzylammonium chloride
이름 더 보기
도데킬다이메틸벤질암모늄염화물알킬디메틸벤질암모늄클로라이드염화벤잘코늄도데킬다이메틸벤질암모늄염화물라우랄코늄클로라이드도데실 다이메틸벤질암모늄 클로라이드염화 N-도데실-N,N-다이메틸벤젠메탄아미늄염화 N-도데실-N,N-다이메틸벤젠메탄아미늄 (1:1)염화 로릴다이메틸벤질암모늄염화 벤조도데시늄염화 벤질다이메틸도데실암모늄염화 벤질다이메틸로릴암모늄염화 벤질도데실다이메틸암모늄염화 벤질디메틸도데실암모늄염화 벤질로릴다이메틸암모늄1227DDBACDODECYL DIMETHYL BENZYL AMMONIUM CHLORIDEDIMETHYLBENZYLLAURYLAMMONIUM CHLORIDESurfactant1227c12-alkylbenzyldimethylammonium chloride
Benzododecinium chloride [INN]N-Lauryldimethylbenzylammonium chlorideN-Dodecyl-N,N-dimethylbenzenemethanaminium chlorideTetranilSwanolN-Dodecyldimethylbenzylammonium chlorideDTXSID2040787EINECS 205-351-5
데이터베이스 식별자
- CAS
139-07-1- PubChem CID
- 8753
- DTXSID
DTXSID2040787- ChEMBL
CHEMBL1885899- ChEBI
CHEBI:167208- UNII
- Y5A751G47H
- EC Number
- 205-351-5
물성
구조 계산 물성
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 23
- 형식 전하
- 0
- 복잡도
- 240
실험 및 물리화학적 성질
Chemical ClassesNitrogen Compounds -> Quaternary Amines
CosmeticsPreservative; Antistatic
Pesticides
Herbicides
Active substance -> EU Pesticides database: Not approved
Biocide
물리화학적 성질
- 녹는점
- 60 °C · ~60 °C
- 끓는 점
- 162.7 ℃[at · 162.7℃[at 101 325 Pa]
- 밀도
- 1.03 · 1.03[at 20℃]
- 증기압
- 0 Pa · 0Pa at 20℃
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 866 g/L · 866g/L in organic solvents at 20 ℃
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
- 수용성
- 2 g/L · 2g/L at 20℃
- BRN
- 3921689 · 3921689
- 안정성
- 흡습성
- 화장품 원료 기능
- 대전방지제항균 방부제
- InChI
- InChI=1S/C21H38N.ClH/c1-4-5-6-7-8-9-10-11-12-16-19-22(2,3)20-21-17-14-13-15-18-21;/h13-15,17-18H,4-12,16,19-20H2,1-3H3;1H/q+1;/p-1
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H302+H312 (33.2%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]
P260, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 313 reports by companies from 15 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
유해성 정보
Regulatory Information
Chemical: Benzenemethanaminium, N-dodecyl-N,N-dimethyl-, chloride
2004/129/EC
Status: Active Update: 29-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/30313
N-Dodecyl-N,N-dimethylbenzenemethanaminium chloride: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Benzalkonium halides
Hazards Summary
Mild skin irritant; Ingestion hazard; [EPA OHM/TADS] Occupational asthma in a pharmacist confirmed by broncho-provocation testing and PEF; [Malo] Allergic contact dermatitis is infrequently documented for quaternary ammonium compounds; [Marks, p. 266] Quaternary ammonium compounds have curare-like properties when concentrated solutions are ingested; Affected patients may have methemoglobinemia and hemolysis and die within 1-3 hours; Elevated liver function tests were reported; Concentrated solutions can cause burns; No data on carcinogenicity or teratogenicity; [IPCS-PIMs]
Hazard Classes and Categories
Acute Tox. 4 (99.7%)
Acute toxicity (ingestion) - category 4
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Substances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.
Substances used on inanimate objects that destroy harmful microorganisms or inhibit their activity. Disinfectants are classed as complete, destroying SPORES as well as vegetative forms of microorganisms, or incomplete, destroying only vegetative forms of the organisms. They are distinguished from ANTISEPTICS, which are local anti-infective agents used on humans and other animals. (From Hawley's Condensed Chemical Dictionary, 11th ed)
용도 및 제조
Uses
Used in contact lens solutions, eye solutions, cosmetics, and mouthwashes; also used in medical and dental cold sterilization solutions; [Marks, p. 236] Quarternary ammonium compounds are also used as algaecides/slimicides (swimming pools, industrial water reservoirs, and farm ponds), antiseptics for cleaning wounds, antistatic agents for textiles, softeners for paper products, and pigment dispersers; [IPCS-PIMs]
Using Disinfectants or Biocides [Category: Clean]
Use ClassificationCosmetics -> Preservative; Antistatic
General Manufacturing InformationBenzenemethanaminium, N-dodecyl-N,N-dimethyl-, chloride (1:1): ACTIVE
응용 분야
용도Quaternary ammonium composition to treat herpes, pseudomonas, staph, hepatitis and other infectious diseases.
상·하류 제품 정보
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