기본 정보
- 표준 SMILES
O=C1CCN(c2ccccc2)N1- InChIKey
CMCWWLVWPDLCRM-UHFFFAOYSA-N- 분자식
- C9H10N2O
- 평균 분자량
- 162.19 g/mol
- 단동위원소 질량
- 162.07931294
개요
photographic developer; RN given refers to parent cpd; structure
이름 및 식별자
- 우선 이름
- Phenidone
- IUPAC
- 1-phenylpyrazolidin-3-one
- 현지명
- 1-페닐-3-피라졸리돈
- 영어명
- Phenidone
- 분자식
- C9H10N2O
- 분자량
- 162.19
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
92-43-3- PubChem CID
- 7090
- DTXSID
DTXSID1049433- ChEMBL
CHEMBL7660- UNII
- H0U5612P6K
- EC Number
- 202-155-1
- Nikkaji
- J38.160H
물성
구조 계산 물성
- XLogP
- 0.9
- 극성 표면적
- 32.3 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 175
실험 및 물리화학적 성질
물리화학적 성질
- 녹는점
- 119 · 119-121 °C(lit.)
- 끓는 점
- 288.88 °C · 288.88°C (rough estimate)
- 밀도
- 1.1436 · 1.1436 (rough estimate)
- 증기압
- 0.002 Pa · 0.002Pa at 25℃
- 굴절률
- 1.56 · 1.5600 (estimate)
- 저장 조건
- Sealed in dry,Room Temperature
- 용해도
- 0.1 g/mL, · 메탄올: 0.1 g/mL, 투명
- 물리적 상태
- 흰색 내지 회백색 고체.
- 산도 계수 (pKa)
- 9.5 · 9.50±0.30(Predicted)
- 색상
- White to Light yellow to Light orange
- 수용성
- 뜨거운 물에 용해됨
- Merck
- 14 · 14,7309
- BRN
- 131856 · 131856
- 안정성
- 안정적이지만 빛에 민감합니다. 강산, 강산화제, 강염기와 호환되지 않습니다.
- InChI
- 1S/C9H10N2O/c12-9-6-7-11(10-9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,12)
- InChIKey
- CMCWWLVWPDLCRM-UHFFFAOYSA-N
- SMILES
- O=C1CCN(N1)c2ccccc2
- LogP
- 0.119 at · 0.119 at 25℃
- NIST
- 1 · 1-Phenyl-3-pyrazolidinone(92-43-3)
- EPA
- 3 · 3-Pyrazolidinone, 1-phenyl- (92-43-3)
화학적 성질
light beige powder or crystals
안전 및 규제
GHS 분류
GHS Classification
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Warning
H302 (98.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
유해성 정보
Regulatory Information
Chemical: 3-Pyrazolidinone, 1-phenyl-
Status: Active Update: 12-05-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/17573
3-Pyrazolidinone, 1-phenyl-: 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
Acute Tox. 4 (98.4%)
Acute toxicity - category 4
Acute Tox. 4 *
독성 정보
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- UQ8750000
- ridadr
- UN 2811 6.1/PG 3
- 독성
- LD50 orl-rat: 200 mg/kg KODAK* -,-,71
- HS 번호
- 29331990
- risk_code
- 22-51/53
- hazard_code
- Xn,N
- safety_code
- 61
- 포장분류
- III
- 위험 등급
- 6.1
- 기존화학 물질
- KE-28439
- Hazard Classifications
- Acute Tox. 4 OralAquatic Chronic 2
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Naturally occurring or synthetic substances that inhibit or retard oxidation reactions. They counteract the damaging effects of oxidation in animal tissues.
Compounds that bind to and inhibit that enzymatic activity of LIPOXYGENASES. Included under this category are inhibitors that are specific for lipoxygenase subtypes and act to reduce the production of LEUKOTRIENES.
Compounds or agents that combine with cyclooxygenase (PROSTAGLANDIN-ENDOPEROXIDE SYNTHASES) and thereby prevent its substrate-enzyme combination with arachidonic acid and the formation of eicosanoids, prostaglandins, and thromboxanes.
용도 및 제조
Uses
Used as a non-staining, high-contrast photographic developer; [Merck Index] Used in photography (developer); [www.ci.tucson.az.us/arthazards/medium.html]
Photographic Processing [Category: Other]
응용 분야
개요Phenidone is a moderately active developing agent that exhibits a synergistic effect when combined with other developing agents. The developing behavior of phenidone indicates that, in most cases, it has no induction period and produces a rapid development curve. A developer containing phenidone and hydroquinone (PQ-type developer) is now the predominant type of developer used for X-ray films and provides excellent development performance.
용도Phenidone is used as black and white photographic developer.
상·하류 제품 정보
상류 원료
공급사50 곳
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