기본 정보
- 표준 SMILES
CN(C)c1ccc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccccc2Cl)cc1.[Cl-]- InChIKey
GRPFBMKYXAYEJM-UHFFFAOYSA-M- 분자식
- C23H24Cl2N2
- 평균 분자량
- 399.4 g/mol
- 단동위원소 질량
- 398.1316542
이름 및 식별자
- 우선 이름
- Basic Blue 1
- IUPAC
- [4-[(2-chlorophenyl)-[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium chloride
- 현지명
- 프리모시아닌6GX
- 영어명
- PRIMOCYANINE 6GX
- 분자식
- C23H24Cl2N2
- 분자량
- 399.36
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
3521-06-0- PubChem CID
- 107404
- DTXSID
DTXSID30883984- UNII
- 92N74OA24D
- EC Number
- 222-531-9
물성
구조 계산 물성
- 극성 표면적
- 6.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 27
- 형식 전하
- 0
- 복잡도
- 557
물리화학적 성질
- 물리적 상태
- powder to crystal
- 색상
- Orange to Brown to Dark purple
- EPA
- 1 · C.I. Basic Blue 1 (3521-06-0)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 66.7% (2 of 3) of all reports.
Danger
H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral];H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H400 (33.3%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P264, P264+P265, P270, P273, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 2 of 3 reports by companies.;There is 1 notification provided by 1 of 3 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Regulatory Information
Chemical: Methanaminium, N-[4-[(2-chlorophenyl)[4-(dimethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, chloride
Methanaminium, N-[4-[(2-chlorophenyl)[4-(dimethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, chloride: 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.
규제 정보
Regulatory Information
Chemical: Methanaminium, N-[4-[(2-chlorophenyl)[4-(dimethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, chloride
Methanaminium, N-[4-[(2-chlorophenyl)[4-(dimethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-methyl-, chloride: 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.
안전 데이터
- tsca
- TSCA listed
- HS 번호
- 3204.13.8000
- 기존화학 물질
- KE-06938
화학 및 산업
용도 및 제조
제조 방법
2-Chlorobenzaldehyde and N,N-dimethylaniline condensation, and then used lamps and acid oxidation its product.
상·하류 제품 정보
상류 원료
공급사32 곳
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