기본 정보
- CAS
5406-12-2- 표준 SMILES
Cc1ccc(CCC=O)cc1- InChIKey
ABGZWIFTZXUDGF-UHFFFAOYSA-N- 분자식
- C10H12O
- 평균 분자량
- 148.2 g/mol
- 단동위원소 질량
- 148.088815
이름 및 식별자
- 우선 이름
- 3-(p-Methylphenyl)propanal
- IUPAC
- 3-(4-methylphenyl)propanal
- 현지명
- p-메틸하이드록신나믹알데하이드
- 영어명
- 3-(4-METHYLPHENYL)PROPIONALDEHYDE
- 분자식
- C10H12O
- 분자량
- 148.2
이름 및 동의어
5406-12-2Benzenepropanal, 4-methyl-3-(4-methylphenyl)propanal3-(4-METHYLPHENYL)PROPIONALDEHYDEp-Methylhydrocinnamic aldehydeHydrocinnamaldehyde, p-methyl-3-p-Tolylpropionaldehyde3-(p-Methylphenyl)propanal4-Methylbenzenepropanal1RMD883W6C3-(P-TOLYL)PROPIONALDEHYDENSC 5304
이름 더 보기
p-메틸하이드록신나믹알데하이드p-메틸하이드록신나믹알데하이드크레실프로피온알데하이드p-메틸다이하이드로신나믹알데하이드3-(4-메틸페닐)프로피온알데히드CRESYLPROPIONALDEHYDE3-p-Tolylpropionaldehyd4-methyl-benzenepropana4-methyl-Benzenepropanal3-P-TOLYL-PROPIONALDEHYDE4-METHYLHYDROCINNAMALDEHYDEp-MethylhydrocinnamicaldehydePARA-METHYLHYDROCINNAMALDEHYDE
NSC-5304EINECS 226-460-43-P-TOLYLPROPANALDTXSID2063844RefChem:495793DTXCID3041582Hydrocinnamaldehyde, p-methyl-(8CI)3-(p-tolyl)propanal
데이터베이스 식별자
- CAS
5406-12-2- PubChem CID
- 64812
- DTXSID
DTXSID2063844- UNII
- 1RMD883W6C
- EC Number
- 226-460-4
- Nikkaji
- J217.968G
물성
구조 계산 물성
- XLogP
- 2
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 112
실험 및 물리화학적 성질
FragrancesFragrance substance (p-Methylhydrocinnamic aldehyde) -> IFRA amendment 43
물리화학적 성질
- 끓는 점
- 223 °C · 223°C (estimate)
- 밀도
- 0.999 · 0.9990
- 굴절률
- 1.525 · 1.5250 (estimate)
- 용해도
- Insoluble in water, soluble in alcohol and oils.
- 냄새
- 1 % · 디프로필렌 글리콜 중 1.00%. 헬리오트로프 백합 라일락
- 냄새 유형
- 꽃향기
- 화장품 원료 기능
- 향수
- LogP
- 2.58 · 2.580
- EPA
- 4 · Benzenepropanal, 4-methyl- (5406-12-2)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 248 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationChemical: Benzenepropanal, 4-methyl-
Other Safety InformationIMAP assessments - Benzenepropanal, 4-methyl-: Environment tier I assessment
Hazard Classes and CategoriesSkin Sens. 1B (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
IFRA Fragrance Standards
p-Methylhydrocinnamic aldehyde
Benzenepropanal, 4-methyl; p-Methyldihydrocinnamaldehyde; p-Methylhydrocinnamaldehyde; 3-(4-Methylphenyl)propanal; 3-p-Tolylpropionaldehyde
IFRA_STD_164.pdf
43
IFRA 51st Amendment - Guidance for the use of IFRA Standards
Prohibition: This material should not be used as a fragrance ingredient
General Manufacturing InformationBenzenepropanal, 4-methyl-: INACTIVE
응용 분야
용도3-(4-METHYLPHENYL)PROPIONALDEHYDE has been suggested for use in perfume compositions as a supporting floral or floral-balsamic or floral-spicy ingredient in Oriental fragrance types, Sweet Pea, Frangipanni, etc. or in various Fantasy fragrance types. It blends well with the Ionones, Amylsalicylate, Ylang-Ylang, Cinnamic alcohol, etc. and gives interesting depth to a Lilac, with its more delicate notes, generally preferred over Anisaldehyde or similar, harsh odorants.
공급사15 곳
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
天津诺康医药科技有限公司022-23989838 13810451150 · [email protected]
石家庄州昆医药科技有限公司0311-83784138 18633934202 · [email protected]
上海洪创医药科技有限公司18151128828 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
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