기본 정보
- 표준 SMILES
CC(C)=CCCC(C)CC=NO- InChIKey
JUCCIEVMICHZPK-UHFFFAOYSA-N- 분자식
- C10H19NO
- 평균 분자량
- 169.26 g/mol
- 단동위원소 질량
- 169.14666423
이름 및 식별자
- 우선 이름
- 6-Octenal, 3,7-dimethyl-, oxime
- IUPAC
- N-(3,7-dimethyloct-6-enylidene)hydroxylamine
- 현지명
- 3,7-디메틸옥트-6-엔알옥심
- 영어명
- 3,7-dimethyloct-6-enal oxime
- 분자식
- C10H19NO
- 분자량
- 169.26
이름 및 동의어
6-Octenal, 3,7-dimethyl-, oxime22457-25-66-Octenaldoxime, 3,7-dimethyl-EINECS 245-011-3NSC 152365AI3-12093DTXSID30885206RefChem:105191DTXCID301024600Citronellal oximeCitronellaloximSCHEMBL3273714
이름 더 보기
3,7-디메틸옥트-6-엔알옥심3,7-Dimethyl-6-octenal oxime3,7-dimethyloct-6-enal oxime
3,7-dimethyl-oct-6-enal oximeNS00050124N-(3,7-dimethyloct-6-en-1-ylidene)hydroxylamine
데이터베이스 식별자
- CAS
22457-25-6- PubChem CID
- 89723
- DTXSID
DTXSID30885206- EC Number
- 245-011-3
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 32.6 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 157
물리화학적 성질
- 끓는 점
- 124 · 124-125 °C
- 밀도
- 0.8971 g/cm3 · 0.8971 g/cm3(Temp: 27.5 °C)
- 산도 계수 (pKa)
- 11.29 · 11.29±0.14(Predicted)
- 냄새
- 100 %에서 · 100.00%에서. 감귤 베르가못 라임
- 냄새 유형
- 감귤류
- LogP
- 3.253 · 3.253 (est)
- EPA
- 6 · 6-Octenal, 3,7-dimethyl-, oxime (22457-25-6)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 1.9% (2 of 106) of reports.
Warning
H319 (98.1%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H411 (98.1%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P264+P265, P273, P280, P305+P351+P338, P337+P317, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 106 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 2 of 106 reports by companies.；There is 1 notification provided by 104 of 106 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Regulatory InformationStatus: Active Update: 21-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21706
Hazard Classes and CategoriesEye Irrit. 2 (98.1%)；Aquatic Chronic 2 (98.1%)
규제 정보
Regulatory InformationStatus: Active Update: 21-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21706
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information6-Octenal, 3,7-dimethyl-, oxime: ACTIVE
상·하류 제품 정보
상류 원료
공급사2 곳
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
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