홈MCP워크벤치Skills
홈워크벤치알림마이페이지
Huagongshe 오픈 프로젝트:[email protected]AI 접속: llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.7.8
  1. 홈
  2. /화합물

Piperonylidene acetone

HCID 6040503
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
3160-37-0
표준 SMILES
CC(=O)/C=C/c1ccc2c(c1)OCO2
InChIKey
XIYPXOFSURQTTJ-NSCUHMNNSA-N
분자식
C11H10O3
평균 분자량
190.19 g/mol
단동위원소 질량
190.06299418

개요

Piperonyl acetone is a clear yellow liquid. Insoluble in water. (NTP, 1992)

이름 및 식별자

우선 이름
Piperonylidene acetone
IUPAC
(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one
영어명
3,4-(Methylenedioxy)benzylideneacetone
분자식
C11H10O3
분자량
190.2

이름 및 동의어

Piperonylidene acetonePiperonalacetonePiperonylideneacetoneAcetone, piperonylidene-3,4-(Methylenedioxy)benzalacetone2-Butanone, 4-(3,4-(methylenedioxy)phenyl)-3-Buten-2-one, 4-(3,4-(methylenedioxy)phenyl)-T43BYJ64EG3,4-Methylenedioxybenzyl acetoneNSC-217304NSC-407384RefChem:863612
이름 더 보기
piperonylene-acetonepiperonylidene-aceton5-(3-OXOBUTYL)-1,3-BENZODIOXOLE5-(3-Oxo-1-butenyl)-1,3-benzodioxole4-(1,3-benzodioxol-5-yl)-3-buten-2-on4-(1,3-benzodioxol-5-yl)but-3-en-2-one4-(1,3-benzodioxol-5-yl)-3-buten-2-one
4-(1,3-benzodioxol-5-yl)-3-butene-2-one221-608-4Piperonyl acetone3160-37-03,4-(METHYLENEDIOXY)BENZYLIDENEACETONE4-(Benzo[d][1,3]dioxol-5-yl)but-3-en-2-one(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one3-Buten-2-one, 4-(1,3-benzodioxol-5-yl)-

데이터베이스 식별자

CAS
3160-37-0
PubChem CID
6040503
ChEMBL

물성

구조 계산 물성

XLogP
2.2
극성 표면적
35.5 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
2
무거운 원자 수
14
형식 전하
0
복잡도
247

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Other Aromatic Compounds
Flavoring AgentsEU Flavoring substances
Solubility · 2건

Insoluble (<1 mg/ml) (NTP, 1992)

INSOL IN WATER, PETROLEUM ETHER; SLIGHTLY SOL IN ALCOHOL, HOT WATER; SOL IN ETHER, BENZENE; VERY SOL IN HOT ALCOHOL, CARBON TETRACHLORIDE

Flash Pointgreater than 200 °F (NTP, 1992)
Melting Point111 °C
Vapor Pressure0.000594 [mmHg]
Physical Description · 2건

Piperonyl acetone is a clear yellow liquid. Insoluble in water. (NTP, 1992)

Clear yellow liquid; [CAMEO] White or pale yellow powder; [MSDSonline]

물리화학적 성질

녹는점
108 · 108-110°C
끓는 점
285.69 °C · 285.69°C (rough estimate)
밀도
1.1752 · 1.1752 (rough estimate)
굴절률

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

유해성 정보

Regulatory InformationChemical: 3-Buten-2-one, 4-(1,3-benzodioxol-5-yl)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Fire HazardsThis chemical is probably combustible. (NTP, 1992)
Fire PotentialSLIGHT, WHEN EXPOSED TO HEAT OR FLAME; CAN REACT WITH OXIDIZING MATERIALS. /PIPERONAL/
Hazards SummaryToxic by ingestion; Estimated lethal dose = 1 ounce to 1 pint; [HSDB] May cause irritation; [MSDSonline]
Reactive GroupEthers
Reactivity Profile · 1건

PIPERONYL ACETONE is a ketone. Ketones are reactive with many acids and bases liberating heat and flammable gases (e.g., H2). The amount of heat may be sufficient to start a fire in the unreacted portion of the ketone. Ketones react with reducing agents such as hydrides, alkali metals, and nitrides to produce flammable gas (H2) and heat. Ketones are incompatible with isocyanates, aldehydes, cyanides, peroxides, and anhydrides. They react violently with aldehydes, HNO3, HNO3 + H2O2, and HClO4.

Air and Water ReactionsInsoluble in water.

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

화학 및 산업

용도 및 제조

Household ProductsInformation on 1 consumer products that contain Piperonyl Acetone in the following categories is provided:
General Manufacturing Information3-Buten-2-one, 4-(1,3-benzodioxol-5-yl)-: INACTIVE

응용 분야

일반 설명Clear yellow liquid. Insoluble in water.

공급사16 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]

관련 반응

2건
반응 기록 만들기
HRID 464759 반응식
HRID 464759생성물로uspto-grants-1985_10
HRID 1651357 반응식
HRID 1651357반응물로uspto-grants-1990_05

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
CHEMBL104084
UNII
T43BYJ64EG
EC Number
221-608-4
Nikkaji
J25.345F、J417.066K
1.5854 · 1.5854 (estimate)
BRN
83983 · 83983
EPA
3 · 3,4-(Methylenedioxy)benzalacetone (3160-37-0)
Storage Conditions · 1건

IN GENERAL, MATERIALS WHICH ARE TOXIC AS STORED OR WHICH CAN DECOMP INTO TOXIC COMPONENTS...SHOULD BE STORED IN A COOL, WELL-VENTILATED PLACE, OUT OF DIRECT RAYS OF THE SUN, AWAY FROM AREAS OF HIGH FIRE HAZARD, & SHOULD BE PERIODICALLY INSPECTED... INCOMPATIBLE MATERIALS SHOULD BE ISOLATED FROM EACH OTHER. /PIPERONAL/

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If you spill this chemical, use absorbent paper to pick up liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with toluene followed by washing with a strong soap and water solution. Do no reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Disposal Methods · 1건

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

안전 데이터

tsca
TSCA listed
rtecs
EM9822500
HS 번호
2932990090
safety_code
22-24/25
유해 물질 데이터
3160-37-0(Hazardous Substances Data)
陕西缔都医药化工有限公司
+86-29-81139210 +86-17392587031 · [email protected]
成都安普生医药科技有限公司13568817957 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]