기본 정보
- CAS
155601-30-2- 표준 SMILES
Nc1cnn(CCO)c1N.O=S(=O)(O)O- InChIKey
IBCDZZHMNXXYAP-UHFFFAOYSA-N- 분자식
- C5H12N4O5S
- 평균 분자량
- 240.24 g/mol
- 단동위원소 질량
- 240.05284067
이름 및 식별자
- 우선 이름
- 4,5-Diamino-1-(2-hydroxyethyl)pyrazole sulfate
- IUPAC
- 2-(4,5-diaminopyrazol-1-yl)ethanol;sulfuric acid
- 현지명
- 1-하이드록시에틸4,5-다이아미노피라졸설페이트
- 영어명
- 4,5-Diamino-1-(2-hydroxyethyl)pyrazole sulfate
- 분자식
- C5H10N4O.H2O4S
- 분자량
- 240.24
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
155601-30-2- PubChem CID
- 11673148
- DTXSID
DTXSID20165928- UNII
- 04N8KX12N6
- EC Number
- 429-300-3、605-017-2
물성
구조 계산 물성
- 극성 표면적
- 173 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 15
- 형식 전하
- 0
- 복잡도
- 191
물리화학적 성질
- 녹는점
- 183 ℃ · >183℃
- 밀도
- 1.69 · 1.69-1.87 at 20℃
- 증기압
- 0 · 0-0.003Pa at 20-90℃
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 색상
- 창백한 오렌지
- 화장품 원료 기능
- 색소머리 염색
- LogP
- -1.75 at · -1.75 at 25℃ and pH7
- 표면장력
- 62.8 mN/m · 62.8mN/m at 1-1.01g/L and 20℃
화학적 성질
Off-white to pink powder
안전 및 규제
GHS 분류
GHS Classification
Danger
H317: May cause an allergic skin reaction [Warning Sensitization, Skin];H318: Causes serious eye damage [Danger Serious eye damage/eye irritation];H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Danger
유해성 정보
Regulatory Information
Chemical: 1H-Pyrazole-1-ethanol, 4,5-diamino-, sulfate (1:1) salt;Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.
Status: Active Update: 02-01-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/1370;Status: Active Update: 15-01-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/15650;Status: Active Update: 16-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/13441;Status: Active Update: 03-01-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/8429
1H-Pyrazole-1-ethanol, 4,5-diamino-, sulfate (1:1) (salt): 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
Skin Sens. 1 (100%);Eye Dam. 1 (100%);Aquatic Chronic 2 (100%)
Skin Sens. 1 (100%);Eye Dam. 1 (100%);Aquatic Chronic 2 (100%)
Eye damage - category 1;Skin sensitisation - category 1;Hazardous to the aquatic environment (chronic) - category 2
Eye Dam. 1;Skin Sens. 1;Aquatic Chronic 2
독성 정보
규제 정보
Regulatory Information
Chemical: 1H-Pyrazole-1-ethanol, 4,5-diamino-, sulfate (1:1) salt;Specific Information Requirement: Obligations to provide information apply. You must tell us within 28 days if the circumstances of your importation or manufacture (introduction) are different to those in our assessment.
Status: Active Update: 02-01-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/1370;Status: Active Update: 15-01-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/15650;Status: Active Update: 16-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/13441;Status: Active Update: 03-01-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/8429
1H-Pyrazole-1-ethanol, 4,5-diamino-, sulfate (1:1) (salt): 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
- risk_code
- 41-43-51/53
- hazard_code
- Xi,N
- safety_code
- 24-26-37/39-61
화학 및 산업
용도 및 제조
응용 분야
용도4,5-Diamino-1-(2-hydroxyethyl)pyrazole Sulfate is useful as an oxidative hair dye.
공급사100 곳
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