기본 정보
- CAS
57012-20-1- 표준 SMILES
Cc1cc(CO)n(C)n1- InChIKey
GUJDKMVLHCJODO-UHFFFAOYSA-N- 분자식
- C6H10N2O
- 평균 분자량
- 126.16 g/mol
- 단동위원소 질량
- 126.07931294
이름 및 식별자
- 우선 이름
- (1,3-dimethyl-1H-pyrazol-5-yl)methanol
- IUPAC
- (2,5-dimethylpyrazol-3-yl)methanol
- 현지명
- (1,3-DIMETHYL-1H-PYRAZOL-5-YL)메탄올
- 영어명
- (1,3-Dimethyl-1H-pyrazol-5-yl)methanol
- 분자식
- C6H10N2O
- 분자량
- 126.16
이름 및 동의어
(1,3-Dimethyl-1H-pyrazol-5-yl)methanol57012-20-1DTXSID60380017RefChem:204329DTXCID00331043844-062-4(2,5-dimethylpyrazol-3-yl)methanol1H-Pyrazole-5-methanol, 1,3-dimethyl-MFCD02682037(1,3-Dimethyl-1H-pyrazole-5-yl)methanol1H-Pyrazole-5-methanol,1,3-dimethyl-(1,3-dimethylpyrazol-5-yl)methan-1-ol
이름 더 보기
(1,3-DIMETHYL-1H-PYRAZOL-5-YL)메탄올AKOS PAO-0016BUTTPARK 93\11-63RARECHEM AL BD 1315(2,5-dimethyl-3-pyrazolyl)methanol3-diMethyl-1H-pyrazol-5-yl)Methanol1,3-Dimethyl-1H-pyrazole-5-methanol1,3-DIMETHYL-5-(HYDROXYMETHYL)PYRAZOLE(2,5-Dimethyl-2H-pyrazol-3-yl)methanol
1,3-Dimethyl-5-(hydroxymethyl)-1H-pyrazoleA1EFF1,3-Dimethyl-5-hydroxymethyl-1H-pyrazole(2,5-DIMETHYL-2H-PYRAZOL-3-YL)-METHANOLSCHEMBL243531SCHEMBL243532orb3029888SCHEMBL1387546
데이터베이스 식별자
- CAS
57012-20-1- PubChem CID
- 2776363
- DTXSID
DTXSID60380017- EC Number
- 844-062-4
물성
구조 계산 물성
- XLogP
- -0.2
- 극성 표면적
- 38.1 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 9
- 형식 전하
- 0
- 복잡도
- 97.1
물리화학적 성질
- 끓는 점
- 117 · 117-118°C 0,8mm
- 밀도
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- 저장 조건
- Sealed in dry,Room Temperature
- 산도 계수 (pKa)
- 14.37 · 14.37±0.10(Predicted)
화학적 성질
Light yellow solid
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- HS 번호
- 29339900
- risk_code
- 36/37/38-22
- hazard_code
- Xi,Xn
- safety_code
- 26-36/37/39
- 위험 참고 사항
- Irritant
화학 및 산업
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