기본 정보
- CAS
73398-89-7- 표준 SMILES
CCN(CC)c1ccc2c(-c3ccccc3C(=O)OC)c3ccc(=[N+](CC)CC)cc-3oc2c1.CCN(CC)c1ccc2c(-c3ccccc3C(=O)OC)c3ccc(=[N+](CC)CC)cc-3oc2c1.[Cl][Zn-2]([Cl])([Cl])[Cl]- InChIKey
NILXVRMPJNDXNM-UHFFFAOYSA-J- 분자식
- C58H66Cl4N4O6Zn
- 평균 분자량
- 1,122.4 g/mol
- 단동위원소 질량
- 1,118.302788
개요
See other relationships...
이름 및 식별자
- 우선 이름
- 3,6-Bis(diethylamino)-9-(2-(methoxycarbonyl)phenyl)xanthylium tetrachlorozincate
- IUPAC
- bis([6-(diethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-diethylazanium);tetrachlorozinc(2-)
- 현지명
- 3,6-비스(디에틸아미노)-9-(2-(메톡시카보닐)페닐)크산틸륨, (T-4)-테트라클로로아연산(1-)
- 영어명
- Basic Violet 11:1
- 분자식
- C29H33Cl4N2O3Zn-
- 분자량
- 664.77
이름 및 동의어
3,6-Bis(diethylamino)-9-(2-(methoxycarbonyl)phenyl)xanthylium tetrachlorozincate3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]xanthylium tetrachlorozincateXanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, (T-4)-tetrachlorozincate(2-) (2:1)Xanthylium, 3,6-bis(diethylamino)-9-(2-(methoxycarbonyl)phenyl)-, (T-4)-tetrachlorozincate(2-) (2:1)RefChem:487449DTXCID601839252Xanthylium, 3,6-bis(diethylamino)-9-2-(methoxycarbonyl)phenyl-, (T-4)-tetrachlorozincate(2-) (2:1)DTXSID50879783Basic Violet 11:173398-89-7[6-(diethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]-diethylazanium;tetrachlorozinc(2-)4PG1Z300FR
이름 더 보기
3,6-비스(디에틸아미노)-9-(2-(메톡시카보닐)페닐)크산틸륨,(T-4)-테트라클로로아연산(1-)3,6-비스(디에틸아미노)-9-(2-(메톡시카보닐)페닐)크산틸륨,(T-4)-테트라클로로아연산(1-)(3,6...asicViolet11:1Basic Violet 11:1 ISO 9001：2015 REACHC.I. Basic Violet 11:1 tetrachlorozincate(1-)3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]xanthyliu...
물성
구조 계산 물성
- 극성 표면적
- 83.6 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 16
- 무거운 원자 수
- 73
- 형식 전하
- 0
- 복잡도
- 845
실험 및 물리화학적 성질
Physical DescriptionDry Powder; Gas Vapor; Wet Solid; Other Solid
물리화학적 성질
- 밀도
- 1.31 · 1.31[at 20℃]
- 수용성
- 22.1 g/L · 22.1g/L at 20℃
- 화장품 원료 기능
- 머리 염색
- InChIKey
- JLJFMVKPMRVLPD-UHFFFAOYSA-J
- SMILES
- [Zn+2]([Cl-])([Cl-])([Cl-])[Cl-].C(C1C=CC=CC=1C1C2=CC=C(N(CC)CC)C=C2[O+]=C2C=C(N(CC)CC)C=CC=12)(=O)OC
- LogP
- 1 at · 1 at 20℃
- EPA
- 3 · Xanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, (T-4)-tetrachlorozincate(2-) (2:1) (73398-89-7)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H301 (17.1%): Toxic if swallowed [Danger Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P354+P338, P316, P317, 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 765 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Xanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, (T-4)-tetrachlorozincate(2-) (2:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Xanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, (T-4)-tetrachlorozincate(2-) (2:1) 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)
REACH registered substance: 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]xanthylium tetrachlorozincate (EC: 277-459-0)
Xanthylium, 3,6-bis(diethylamino)-9-2-(methoxycarbonyl)phenyl-, (T-4)-tetrachlorozincate(2-) (2:1): Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 3 (17.1%)
안전 데이터
- tsca
- TSCA listed
- ridadr
- 3143
- 포장분류
- II
- 위험 등급
- 6.1(a)
- 기존화학 물질
- KE-03022
화학 및 산업
용도 및 제조
U.S. Production2023: 54,365 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesDye
General Manufacturing Information
Paint and Coating Manufacturing
Xanthylium, 3,6-bis(diethylamino)-9-[2-(methoxycarbonyl)phenyl]-, (T-4)-tetrachlorozincate(2-) (2:1): ACTIVE
상·하류 제품 정보
상류 원료
공급사24 곳
河南英田生物科技有限公司0370-4053511; 18339993703 · [email protected]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
超彩实业有限公司0574-83851061 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
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