기본 정보
- 표준 SMILES
C[C@@H]1CN(CCN)C[C@H](C)O1- InChIKey
GLOJLKCUVTZRFO-OCAPTIKFSA-N- 분자식
- C8H18N2O
- 평균 분자량
- 158.24 g/mol
- 단동위원소 질량
- 158.1419132
이름 및 식별자
- 우선 이름
- 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethan-1-amine
- IUPAC
- 2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethanamine
- 현지명
- 4-(2-아미노에틸)-CIS-2,6-디메틸모르폴린
- 영어명
- 4-(2-AMINOETHYL)-CIS-2,6-DIMETHYLMORPHOLINE
- 분자식
- C8H18N2O
- 분자량
- 158.24
이름 및 동의어
1092649-16-52-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethan-1-amine2-((2R,6S)-2,6-dimethylmorpholin-4-yl)ethan-1-amineRefChem:447896830-991-24-(2-Aminoethyl)-cis-2,6-dimethylmorpholine2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]ethanaminecis-2,6-dimethylaminoethylmorpholine2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanamineMFCD06239282SCHEMBL2151256SCHEMBL2443514
이름 더 보기
4-(2-아미노에틸)-CIS-2,6-디메틸모르폴린4-Morpholineethanamine, 2,6-dimethyl-,(2R,6S)-rel-
GLOJLKCUVTZRFO-OCAPTIKFSA-NUJA78918AKOS006344017FS-4916EN300-1236556F019579Rel-2-((2R,6S)-2,6-dimethylmorpholino)ethan-1-amine4-(2-Aminoethyl)-cis-2,6-dimethylmorpholine, AldrichCPR
데이터베이스 식별자
- CAS
1092649-16-5- PubChem CID
- 7144968
- EC Number
- 830-991-2
물성
구조 계산 물성
- XLogP
- -0.2
- 극성 표면적
- 38.5 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 11
- 형식 전하
- 0
- 복잡도
- 109
물리화학적 성질
- 끓는 점
- 224.6 · 224.6±20.0 °C(Predicted)
- 밀도
- 0.931 · 0.931±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- 9.98 · 9.98±0.10(Predicted)
안전 및 규제
GHS 분류
GHS Classification
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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
Hazard Classes and CategoriesSkin Corr. 1B (100%)；STOT SE 3 (100%)
안전 데이터
- risk_code
- 22-36
- hazard_code
- Xn
- safety_code
- 26
화학 및 산업
공급사5 곳
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
上海馨远医药科技有限公司021-24206007 13764915196 · [email protected]
苏州启航生物科技有限公司18662190603 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
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