기본 정보
- CAS
17610-21-8- 표준 SMILES
CC(=O)c1ccc2c(c1)C(C)(C)CCC2(C)C- InChIKey
IHUSZOMIBSDQTB-UHFFFAOYSA-N- 분자식
- C16H22O
- 평균 분자량
- 230.34 g/mol
- 단동위원소 질량
- 230.16706532
이름 및 식별자
- 우선 이름
- 1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one
- IUPAC
- 1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethanone
- 영어명
- 1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-one
- 분자식
- C16H22O
- 분자량
- 230.35
이름 및 동의어
17610-21-81-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethan-1-oneDTXSID30372661RefChem:225603DTXCID303236931-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)ethanone1-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)ethanoneMFCD00052727Ethanone, 1-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-6-acetyl-1,2,3,4-tetrahydro-1,1,4,4-tetramethylnaphthaleneC16H22O1-(1,1,4,4-tetramethyltetralin-6-yl)ethanone
이름 더 보기
1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydron6-Acetyl-1,2,3,4-tetrahydro-1,1,4,4-tetramethylnaphtalene6-ACETYL-1,2,3,4-TETRAHYDRO-1,1,4,4-TETRAMETHYLNAPHTHYLENE6-ACETYL-1,2,3,4-TETRAHYDRO-1,1,4,4-TETRAMETHYLNAPHTALENE: TECH.
1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)ethanone2-acetyl-5,6,7,8-tetrahydro-5,5,8,8-tetramethylnaphthalene2-acetyl-5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene1-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-ethanoneCHEMBL556486SCHEMBL2195224IHUSZOMIBSDQTB-UHFFFAOYSA-N1,1,4,4-Tetramethyl-1,2,3,4-tetrahydro-6-acetylnaphthalene
데이터베이스 식별자
- CAS
17610-21-8- PubChem CID
- 2747562
- DTXSID
DTXSID30372661- ChEMBL
CHEMBL556486- Nikkaji
- J2.441.280F
물성
구조 계산 물성
- XLogP
- 4.7
- 극성 표면적
- 17.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 313
물리화학적 성질
- 녹는점
- 26 · 26-27 °C(Solv: methanol (67-56-1))
- 끓는 점
- 98 °C · 98 °C
- 밀도
- 0.941 · 0.941±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C
안전 및 규제
안전 데이터
- HS 번호
- 2914390090
- risk_code
- 36/37/38
- safety_code
- 26-36/37/39
화학 및 산업
공급사25 곳
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