기본 정보
- CAS
53767-93-4- 표준 SMILES
C=CC(C)CCCC(C)(C)OC(C)=O- InChIKey
BEARMGATPGLSKG-UHFFFAOYSA-N- 분자식
- C12H22O2
- 평균 분자량
- 198.3 g/mol
- 단동위원소 질량
- 198.16197994
개요
structure in first source
이름 및 식별자
- 우선 이름
- 2,6-Dimethyl-7-octen-2-yl acetate
- IUPAC
- 2,6-dimethyloct-7-en-2-yl acetate
- 영어명
- Dihydromyrcenyl acetate
- 분자식
- C12H22O2
- 분자량
- 198.3
이름 및 동의어
Dihydromyrcenyl acetate2,6-Dimethyloct-7-en-2-yl acetate53767-93-42,6-Dimethyl-7-octen-2-yl acetateW9O6R2H72I7-Octen-2-ol, 2,6-dimethyl-, acetateDTXSID4052182RefChem:587762DTXCID4030752258-751-77-Octen-2-ol, 2,6-dimethyl-, 2-acetateUNII-W9O6R2H72I
이름 더 보기
DihydromDIHYDROMYRCENYLACETATDihydromyrcenalacetate2,6-dimethyl-7-octen-2-oacetate2,6-Dimethyloct-7-en-2-ylacetat2,6-Dimethyl-7-octen-2-ol acetate
6,10-Dihydromyrcenyl acetateSCHEMBL1582572,6-Dimethyl-7octen-2-yl acetateEINECS 258-751-7DB-052396NS00012253Q27292505
데이터베이스 식별자
- CAS
53767-93-4- PubChem CID
- 103826
- DTXSID
DTXSID4052182- UNII
- W9O6R2H72I
- EC Number
- 258-751-7
- Nikkaji
- J296.040K
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 194
실험 및 물리화학적 성질
FragrancesFragrance Ingredient (Dihydromyrcenyl acetate) -> IFRA transparency List
물리화학적 성질
- 끓는 점
- 213 · 213-218 °C(lit.)
- 밀도
- 0.873 g/mL · 0.873 g/mL at 25 °C(lit.)
- 증기압
- 14.4 Pa · 14.4Pa at 24℃
- 굴절률
- 20 · n20/D 1.4318(lit.)
- 인화점
- 195 °F · 195 °F
- 용해도
- Almost insoluble in water, soluble in alcohol and oils
- 색상
- Colourless mobile liquid
- 냄새
- 100 %에서 · 100.00%에서. 시트러스 베르가못 라임 라벤더
- 냄새 유형
- 감귤류
- 수용성
- 6.1 mg/L · 6.1mg/L at 24℃
- 화장품 원료 기능
- 향수
- LogP
- 4.9 at · 4.9 at 25℃
- EPA
- 7 · 7-Octen-2-ol, 2,6-dimethyl-, acetate (53767-93-4)
화학적 성질
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 14.6% (231 of 1584) of reports.
H411 (85.4%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1584 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: 7-Octen-2-ol, 2,6-dimethyl-, acetate
REACH registered substance: 2,6-dimethyloct-7-en-2-yl acetate (EC: 258-751-7)
7-Octen-2-ol, 2,6-dimethyl-, acetate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAquatic Chronic 2 (85.4%)
안전 데이터
- wgk
- 2
- tsca
- TSCA listed
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- 기존화학 물질
- KE-11680
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
General Manufacturing Information7-Octen-2-ol, 2,6-dimethyl-, 2-acetate: ACTIVE
응용 분야
용도Dihydro-myrcenol acetate is more stable than Myrcenyl acetate, which tends to polymerize upon standing. It is not quite as powerful and does not give the same effect as soap (perfume). But it has a different odour character, is more citrusy fresh, and is more interesting for modern versions of the “Continental” style Citrus-cologne. It will also support the Lime notes in Lime or Lime-Lemon fragrances, a very modern and much-demanded type in recent years (1967- 68). Novel effects in Jasmin bases are also achieved with this ester.
공급사18 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Syntechem Co.,Ltd[email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
관련 반응
24건
화합물 노트
불러오는 중…