기본 정보
- CAS
1489-56-1- 표준 SMILES
CC1=CC=CCC1- InChIKey
QMFJIJFIHIDENY-UHFFFAOYSA-N- 분자식
- C7H10
- 평균 분자량
- 94.15 g/mol
- 단동위원소 질량
- 94.07825032
개요
1-Methyl-1,3-cyclohexadiene is a hydrocarbon.
이름 및 식별자
- 우선 이름
- 1-Methylcyclohexa-1,3-diene
- IUPAC
- 1-methylcyclohexa-1,3-diene
- 영어명
- 1-Methyl-1,3-cyclohexadiene
- 분자식
- C7H10
- 분자량
- 94.15
이름 및 동의어
1-Methyl-1,3-cyclohexadiene1-Methylcyclohexa-1,3-diene1489-56-15,6-DihydrotolueneMethylcyclohexadiene2,3-Dihydrotoluene1,3-Cyclohexadiene, 1-methyl-30640-46-1Cyclohexadiene, methyl-lemon hexadieneNZ9H475GT1EINECS 216-071-8
이름 더 보기
1-MEthyl-cyclohexa-1,3-diene
DTXSID70892095EINECS 250-269-5LimedieneFEMA NO. 4311, METHYLCYCLOHEXADIENE-RefChem:43457694UK140GDPDTXCID4030548DTXSID1051985
데이터베이스 식별자
- CAS
1489-56-1、30640-46-1- PubChem CID
- 121731
- DTXSID
DTXSID70892095- ChEBI
CHEBI:165805- UNII
- NZ9H475GT1
- EC Number
- 216-071-8、250-269-5
- Nikkaji
- J206.693I
물성
구조 계산 물성
- XLogP
- 2.1
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 7
- 형식 전하
- 0
- 복잡도
- 107
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (Methyl cyclohexadiene (mixture of isomers)) -> IFRA transparency List
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density
0.846-0.853
0.830-0.837
Flavoring AgentsEU Flavoring substances
Solubility
Insoluble in water; soluble in most fixed oils
Soluble (in ethanol)
Practically insoluble to insoluble
Slightly Soluble (in ethanol)
Boiling Point
118.00 to 120.00 °C. @ 760.00 mm Hg
118-120 °C
105 °C
Refractive Index
1.446-1.452
1.474-1.484
Physical Description
Colourless oily liquid; Light fruity aroma
Colorless liquid, Strong lemon-lime top note
물리화학적 성질
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P301+P316, P303+P361+P353, P331, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 131 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
유해성 정보
Regulatory Information
Chemical: 1,3-Cyclohexadiene, 1-methyl-
Chemical: Cyclohexadiene, methyl-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Cyclohexadiene, methyl-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and Categories
Flam. Liq. 2 (100%)
Flam. Liq. 2 (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
약리 정보
Cellular LocationsMembrane
용도 및 제조
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing Information
1,3-Cyclohexadiene, 1-methyl-: INACTIVE
Cyclohexadiene, methyl-: ACTIVE
응용 분야
개요By dehalogenation of 1,2-dibromo-l-methyl cyclohexane with sodium ethoxide; purified by distillation over metallic sodium.
상·하류 제품 정보
하류 제품
공급사8 곳
苏州启航生物科技有限公司18151111370
韶远科技(上海)有限公司4000665055 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
深圳利斯康医药科技有限公司
관련 반응
1건
화합물 노트
불러오는 중…