1-하이드록시프탈라진
1(2H)-Phthalazinone
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기본 정보
- CAS
119-39-1- 표준 SMILES
O=c1[nH]ncc2ccccc12- InChIKey
IJAPPYDYQCXOEF-UHFFFAOYSA-N- 분자식
- C8H6N2O
- 평균 분자량
- 146.15 g/mol
- 단동위원소 질량
- 146.04801281
개요
1-(2h)-phthalazinone appears as pale yellow crystals. Insoluble in water. (NTP, 1992)
이름 및 식별자
- 우선 이름
- 1(2H)-Phthalazinone
- IUPAC
- 2H-phthalazin-1-one
- 현지명
- 1-하이드록시프탈라진
- 영어명
- 1-hydroxyphthalazine
- 분자량
- 0
이름 및 동의어
1(2H)-PHTHALAZINONE119-39-1Phthalazin-1(2H)-onePhthalazonePhthalazin-1-one1-PhthalazinolDTXSID4025903463ZJB0EI2CHEBI:34023DTXCID505903RefChem:863029204-319-8
이름 더 보기
1-하이드록시프탈라진Phthalazinol (9CI)
Phthalazinone2H-Phthalazin-1-onephthalazin-1-ol1-Hydroxyphthalazine1(2H)Phthalazinone1,2-dihydrophthalazin-1-oneMFCD000068921-phthalazinone
데이터베이스 식별자
- CAS
119-39-1、62054-23-3- PubChem CID
- 8394
- DTXSID
DTXSID4025903- ChEMBL
CHEMBL124706- ChEBI
CHEBI:34023- UNII
- 463ZJB0EI2
- EC Number
- 204-319-8
- Nikkaji
- J3.096.279F、J36.830J
물성
구조 계산 물성보충 중
- XLogP
- 0.8
- 극성 표면적
- 41.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 200
실험 및 물리화학적 성질
Chemical ClassesNitrogen Compounds -> Other Nitrogen Rings
PesticidesPesticide degradation product
LogP0.75
SolubilityInsoluble (NTP, 1992)
Boiling Point639 °F at 760 mmHg (NTP, 1992)
Melting Point361 to 363 °F (NTP, 1992)
Vapor Pressure0.00000257 [mmHg]
Physical Description
1-(2h)-phthalazinone appears as pale yellow crystals. Insoluble in water. (NTP, 1992)
Pale yellow solid; [CAMEO] Beige crystalline solid; [Aldrich MSDS]
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Status: Active Update: 07-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21566
1(2H)-Phthalazinone: Does not have an individual approval but may be used under an appropriate group standard
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Hazards SummaryMay cause irritation; [Aldrich MSDS]
Reactive GroupAmides and Imides
Reactivity ProfileThis material reacts with strong oxidizing agents and strong bases [Sigma-Aldrich MSDS].
Air and Water ReactionsInsoluble in water.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 및 보호
Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid
화학 및 산업
용도 및 제조
Uses
Used as a chemical intermediate for hydralazine (antihypertensive agent); [HSDB]
CHEM INT FOR HYDRALAZINE, AN ANTIHYPERTENSIVE AGENT
U.S. Exports
(1977) No Data
(1979) No Data
U.S. Imports
(1976) 6.47X10+6 GRAMS (PRINCPL CUSTMS DISTS)
(1979) 6.01X10+5 GRAMS (PRINCPL CUSTMS DISTS)
U.S. Production
(1977) 1.30X10+8 GRAMS
(1979) PROBABLY GREATER THAN 2.27X10+6 GRAMS
Consumption PatternsPROBABLY 100% AS A CHEMICAL INTERMEDIATE
Methods of ManufacturingREACTION OF PHTHALALDEHYDIC ACID WITH HYDRAZINE
General Manufacturing Information1(2H)-Phthalazinone: ACTIVE
관련 반응
32건
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