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디메틸[4-[4-(디메틸아미노)-알파-페닐벤질리덴]-2,5-시클로헥사디엔-1-일리덴]황산수소암모늄

Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, sulfate (1:1)

HCID 85946
노트반응
기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
16044-24-9
표준 SMILES
CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccccc2)cc1.O=S(=O)([O-])O
InChIKey
VUFBTYDTQCZLCG-UHFFFAOYSA-M
분자식
C23H25N2.HO4S
평균 분자량
426.5 g/mol
단동위원소 질량
426.16132849

이름 및 식별자

우선 이름
Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, sulfate (1:1)
IUPAC
[4-[[4-(dimethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;hydrogen sulfate
현지명
디메틸[4-[4-(디메틸아미노)-알파-페닐벤질리덴]-2,5-시클로헥사디엔-1-일리덴]황산수소암모늄
영어명
dimethyl[4-[4-(dimethylamino)-alpha-phenylbenzylidene]-2,5-cyclohexadien-1-ylidene]ammonium hydrogen sulphate
분자식
C23H26N2O4S
분자량
426.53

이름 및 동의어

16044-24-9EINECS 240-185-7DTXSID8066000Dimethyl(4-(4-(dimethylamino)-alpha-phenylbenzylidene)-2,5-cyclohexadien-1-ylidene)ammonium hydrogen sulphateDimethyl[4-[4-(dimethylamino)-alpha-phenylbenzylidene]-2,5-cyclohexadien-1-ylidene]ammonium hydrogen sulphateMethanaminium, N-(4-((4-(dimethylamino)phenyl)phenylmethylene)-2,5-cyclohexadien-1-ylidene)-N-methyl-, sulfate (1:1)Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, sulfate (1:1)RefChem:156892DTXCID5035165240-185-7Methanaminium, N-(4-((4-(dimethylamino)phenyl)phenylmethylene)-2,5-cyclohexadien-1-ylidene)-N-methyl-, hydrogen sulfateMethanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, hydrogen sulfate
이름 더 보기
디메틸[4-[4-(디메틸아미노)-알파-페닐벤질리덴]-2,5-시클로헥사디엔-1-일리덴]황산수소암모늄C.I. Basic Green 4 (hydrogen sulfate)Dimethyl[4-[4-(dimethylamino)-α-phenylbenzylidene]-2,5-cyclohexadien-1-ylidene]ammonium hydrogen sulphate

물성

구조 계산 물성

극성 표면적
92.1 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
3
무거운 원자 수
30
형식 전하
0
복잡도
592

물리화학적 성질

증기압
0 Pa · 0Pa at 20℃
EPA
4 · Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, hydrogen sulfate (16044-24-9)

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 16.1% (9 of 56) of reports.

Danger

H302 (83.9%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P264, P264+P265, P270, P273, P280, P301+P317, P305+P354+P338, P317, P318, P330, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 56 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

유해성 정보

Regulatory Information · 3건

Chemical: Methanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, hydrogen sulfate

REACH registered substance: Dimethyl[4-[4-(dimethylamino)-α-phenylbenzylidene]-2,5-cyclohexadien-1-ylidene]ammonium hydrogen sulphate (EC: 240-185-7)

Methanaminium, N-4-4-(dimethylamino)phenylphenylmethylene-2,5-cyclohexadien-1-ylidene-N-methyl-, hydrogen sulfate: 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 - Malachite green and related chemicals: Human health tier II assessment
Hazard Classes and Categories · 2건

Acute Tox. 4 (83.9%)

Acute toxicity - category 4

안전 데이터

tsca
TSCA listed
ridadr
3077
포장분류
III
위험 등급
9

화학 및 산업

용도 및 제조

General Manufacturing InformationMethanaminium, N-[4-[[4-(dimethylamino)phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, sulfate (1:1): ACTIVE

공급사2 곳

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]

관련 반응

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화합물 노트

불러오는 중…

이 페이지에서기본 정보이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
Dimethyl[4-[4-(dimethylamino)-?-phenylbenzylidene]-2,5-cyclohexadien-1-ylidene]ammonium hydrogen sulphate
Methanaminium, N-4-4-(dimethylamino)phenylphenylmethylene-2,5-cyclohexadien-1-ylidene-N-methyl-, hydrogen sulfate
VUFBTYDTQCZLCG-UHFFFAOYSA-MSCHEMBL2518588[4-[[4-(dimethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;hydrogen sulfateDB-2302454-{[4-(Dimethylamino)phenyl](phenyl)methylidene}-N,N-dimethylcyclohexa-2,5-dien-1-iminium hydrogen sulfate

데이터베이스 식별자

CAS
16044-24-9
PubChem CID
85946
DTXSID
DTXSID8066000
EC Number
240-185-7