기본 정보
- 표준 SMILES
OC(c1ccccc1)C(F)(F)F- InChIKey
VNOMEAQPOMDWSR-UHFFFAOYSA-N- 분자식
- C8H7F3O
- 평균 분자량
- 176.14 g/mol
- 단동위원소 질량
- 176.0448995
이름 및 식별자
- 우선 이름
- (S)-alpha-(Trifluoromethyl)benzyl alcohol
- IUPAC
- 2,2,2-trifluoro-1-phenylethanol
- 영어명
- (R)-(-)-alpha-(Trifluoromethyl)benzyl alcohol
- 분자식
- C8H7F3O
- 분자량
- 176.14
이름 및 동의어
alpha-(Trifluoromethyl)benzyl alcohol340-04-5EINECS 206-430-7(S)-alpha-(Trifluoromethyl)benzyl alcoholRefChem:408089206-430-7625-547-8340-06-71-Phenyl-2,2,2-trifluoroethanol340-05-62,2,2-Trifluoro-1-phenylethanol2,2,2-trifluoro-1-phenylethan-1-ol
이름 더 보기
(-)-PHENYL(TRIFLUOROMETHYL)CARBINOL(1R)-1-Phenyl-2,2,2-trifluoroethanol(1R)-2,2,2-Trifluoro-1-phenylethanol(R)-2,2,2-trifluoro-1-phenylethan-1-ol(αR)-α-(Trifluoromethyl)benzenemethanol(R)-(-)-2,2,2-TRIFLUORO-1-PHENYLETHANOL(R)-(-)-1-PHENYL-2,2,2-TRIFLUOROETHANOL(r)-(-)-α-(trifluoromethyl)benzyl alcohol(R)-(-)-α-(Trifluoromethyl)benzyl Alcohol(R)-2,2,2-Trifluoro-1-phenylethanol,99%e.e.
MFCD00004498alpha-(trifluoromethyl)benzylalcoholAlpha-(trifluoromethyl)benzyl?alcoholalpha-(Trifluoromethyl)benzenemethanol2,2,2-Trifluoro-1-phenyl-ethanolBenzenemethanol, alpha-(trifluoromethyl)-1-PHENYL-2,2,2-TRIFLUOROETHAN-1-OLBenzyl alcohol, alpha-(trifluoromethyl)-
데이터베이스 식별자
- CAS
10531-50-7、340-04-5、340-05-6、340-06-7- PubChem CID
- 95556
- DTXSID
DTXSID001365774- ChEMBL
CHEMBL320271- EC Number
- 206-429-1、206-430-7、625-547-8
- Nikkaji
- J227.686K
물성
구조 계산 물성
- XLogP
- 2.2
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 138
물리화학적 성질
- 녹는점
- 20 °C · 20 °C(lit.)
- 끓는 점
- 73 · 73-76 °C9 mm Hg(lit.)
- 밀도
- 1.3 g/mL · 1.300 g/mL at 20 °C(lit.)
- 굴절률
- 20 · n20/D 1.459(lit.)
- 인화점
- 189 °F · 189 °F
- 저장 조건
- Keep in dark place,Inert atmosphere,Room temperature
- 물리적 상태
- 투명한 액체
- 산도 계수 (pKa)
- 11.91 · 11.91±0.10(Predicted)
- 색상
- 무색 내지 거의 무색
안전 및 규제
GHS 분류
GHS Classification
Warning
H315 (100%): 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 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
유해성 정보
Hazard Classes and Categories
Skin Irrit. 2 (100%)
Skin Irrit. 2 (100%)
Skin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- ridadr
- NA 1993 / PGIII
- HS 번호
- 29062990
- risk_code
- 36/37/38
- hazard_code
- Xi,C
- safety_code
- 26-36
- F 고인화성물질
- 10-23
화학 및 산업
응용 분야
용도(R)-2,2,2-Trifluoro-1-phenylethanol is a building block used in the synthesis of mesoporous metal-organic frameworks.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
宁波振岳医药科技有限公司19817745290 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [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]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
广东云星生物技术有限公司0751-18902340975/189023400307 18902340307 · [email protected]
北京绿百草科技发展有限公司010-61136123 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
大赛璐药物手性技术(上海)有限公司021-50460086-9 15921403865 · [email protected]
ChemeGen 中国18818260767 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
上海迪外化工科技有限公司021-61551100
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海特伯化学科技有限公司+86-21-60341587 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
石家庄手性化学有限公司031185291771 13832391721 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
嘉兴市德亿化工有限公司0573-85866609 13325730825 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
广州市金华大化学试剂有限公司020-84383047 · [email protected]
山东小野化学股份有限公司0539-6362799 20)
上海万千化工有限公司18796480002 18796480002 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
济南尚博医药股份有限公司0531-61320525 15866703830 · [email protected]
上海腾渤医药科技有限公司021-54338626 18017892860 · [email protected]
郑州艾克姆化工有限公司037163312495 13303845143 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
济南尚博生物科技有限公司+8615866703830 · [email protected]
Aladdin Scientific[email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
常州英飒医药科技有限公司15151934985 · [email protected]
杭州文德阶生物科技有限公司0571-86706360 18158111080 · [email protected]
上海研邦医药科技有限公司15618536883 · [email protected]
관련 반응
24건
연결된 노트
불러오는 중…