옥테니딘에이치씨엘
옥테니딘에이치씨엘 · Octenidine hydrochloride · Octenidine DiHCl · N,N'-(decane-1,10-diyldi-1(4H)-pyridyl-4-ylidene)bis(octylammonium) dichloride · SOT360 · Otinidine hydrochloride · ocenidine dihydrochloride · OCTENIDINE DIHYDROCHLORIDE
식별자 및 물리적 특성
| CAS No. | 70775-75-6 |
|---|---|
| 분자식 | C36H62N4.2ClH |
| 평균 분자량 | 623.8 g/mol |
| 단동위원소 질량 | 622.4508034 g/mol |
| SMILES | CCCCCCCCN=c1ccn(CCCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1.Cl.Cl |
| InChIKey | SMGTYJPMKXNQFY-UHFFFAOYSA-N |
| PubChem CID | 51166 |
| ChEMBL | CHEMBL36342 |
| EC No. | 274-861-8 |
| 현지명 | 옥테니딘에이치씨엘 |
화학 및 물리적 성질
| 극성 표면적 | 31.2 |
|---|---|
| 수소 결합 공여자 수 | 2 |
| 수소 결합 수용자 수 | 4 |
| 회전 가능 결합 수 | 25 |
| 무거운 원자 수 | 42 |
| 형식 전하 | 0 |
| 복잡도 | 691 |
| 녹는점 | 215-217℃ |
| 밀도 | 1.046[at 20℃] |
| 증기압 | 0Pa at 25℃ |
| 저장 조건 | Keep in dark place,Inert atmosphere,Room temperature |
| 용해도 | 디메틸설폭사이드와 메탄올에 용해됩니다. |
| 물리적 상태 | 고체 |
| 색상 | 흰색에서 황백색까지 |
| 용해도 | 14.2g/L at 20℃ |
| Merck | 14,6754 |
| 안정성 | 흡습성 |
| 화장품 원료 기능 | 항균 |
| InChIKey | SMGTYJPMKXNQFY-UHFFFAOYSA-N |
| SMILES | [N+]1(CCCCCCCCCC[N+]2C=CC(NCCCCCCCC)=CC=2)=CC=C(NCCCCCCCC)C=C1.[Cl-].[Cl-] |
| LogP(분배 계수) | 1.5 at 23℃ |
안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 1.4% (1 of 70) of reports.WarningH302 (98.6%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 70 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 규제 정보 | Chemical: 1-Octanamine, N,Nâ²-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)REACH registered substance: N,N'-(decane-1,10-diyldi-1(4H)-pyridyl-4-ylidene)bis(octylammonium) dichloride (EC: 274-861-8)Octenidine hydrochloride: 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. |
| Hazard Classes and Categories | Acute Tox. 4 (98.6%) |
| 관세 코드 | 2933399990 |
용도
개요
The antiseptic agent octenidine dihydrochloride (OCT) was developed by Sterling Winthrop (WIN41464-2) in the 1980s as an alternative to the anti-plaque agent CHX and successfully tested in vitro and in vivo. OCT has a broad spectrum of activity with similar effectiveness against Gram-negative and Gram-positive bacteria, fungi, and yeasts. Moreover, it has been shown that it may effectively interfere with the co-aggregation of dental plaque microbial colonizers without disturbing the normal, healthy oral flora. In a standardized comparison of antimicrobial activity ofthe antiseptic agents triclosan, polyvinylpyrrolidone-iodine, OCT, polyhexamethylene biguanide, and Chlorhexidine digluconat (CHX) using the min-imal effective concentration and minimum bactericidal con-centration, OCT was the most effective active agent of alltested antimicrobial substances. In other studies, the antibacterial and antiplaque efficacy of OCT was equal to or even greater than that of CHX[1].
용도
Octenidine dihydrochloride is used as a antiseptic for skin, mucous Membranes and wounds.