기본 정보
- CAS
10334-26-6- 표준 SMILES
CC12CCC(C(=O)C1=O)C2(C)C- InChIKey
VNQXSTWCDUXYEZ-UHFFFAOYSA-N- 분자식
- C10H14O2
- 평균 분자량
- 166.22 g/mol
- 단동위원소 질량
- 166.09937969
개요
Bornane-2,3-dione is a bornane monoterpenoid that is bicyclo[2.2.1]heptane substituted by methyl groups at positions 1, 7 and 7 and oxo groups at positions 2 and 3. It is a bornane monoterpenoid and a carbobicyclic compound.
이름 및 식별자
- 우선 이름
- Bornane-2,3-dione
- IUPAC
- 1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione
- 영어명
- DL-CAMPHORQUINONE
- 분자식
- C10H14O2
- 분자량
- 166.22
이름 및 동의어
Camphorquinone1,7,7-Trimethylbicyclo[2.2.1]heptane-2,3-dione2,3-Bornanedionebornane-2,3-dione465-29-2Camphor quinoneCamphoquinoneCHEBI:346071,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione bornane-2,3-dione1,7,7-TRIMETHYLBICYCLO(2.2.1)HEPTANE-2,3-DIONE1,7,7-trimethylbicyclo(2.2.1)heptane-2,3-dione bornane-2,3-dioneRefChem:570022
이름 더 보기
CamphorquinonCAMPHOREQUINONERAC-CAMPHORQUINONELABOTEST-BB LT00146630(+/-)-2,3-BORNANEDIONE
207-363-610373-78-1DL-CAMPHORQUINONE(+/-)-CamphorquinoneBicyclo[2.2.1]heptane-2,3-dione, 1,7,7-trimethyl-dl-CamphoroquinoneDTXSID70493941,7,7-trimethylnorbornane-2,3-dione
데이터베이스 식별자
- CAS
10334-26-6、10373-78-1、465-29-2- PubChem CID
- 25208
- DTXSID
DTXSID7049394- ChEMBL
CHEMBL301431- ChEBI
CHEBI:34607- EC Number
- 207-363-6、233-814-1、626-988-9
- Nikkaji
- J21.186I
물성
구조 계산 물성
- XLogP
- 1.5
- 극성 표면적
- 34.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 0
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 278
실험 및 물리화학적 성질
LipidsLipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C10 isoprenoids (monoterpenes) [PR0102]
LogP1.52
물리화학적 성질
- 녹는점
- 197 · 197-203 °C(lit.)
- 끓는 점
- 254.44 °C · 254.44°C (rough estimate)
- 밀도
- 1.006 · 1.0060 (rough estimate)
- 굴절률
- 1.4778 · 1.4778 (estimate)
- 저장 조건
- 2 · 2-8°C
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 11.1% (2 of 18) of reports.
Warning
H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 18 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Bicyclo[2.2.1]heptane-2,3-dione, 1,7,7-trimethyl-
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Camphorquinone: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (88.9%)
안전 데이터
- wgk
- 3
- safety_code
- 22-24/25
화학 및 산업
용도 및 제조
General Manufacturing InformationBicyclo[2.2.1]heptane-2,3-dione, 1,7,7-trimethyl-: ACTIVE
공급사16 곳
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
合肥天健化工有限公司551-65418679 15856988503;15837135945 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
sgtlifesciences pvt ltd+91-8790379245 · [email protected]
Anhuyan (Hainan) Biotechnology Co., LTD+86-18163349544 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392
湖南秉航新材料有限公司85521272 18932438858 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
江西浩硕化工有限公司15307027737 15347922863 · [email protected]
上海齐奥化工科技有限公司021-58892003 · [email protected]
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