기본 정보
- CAS
1011465-27-2- 표준 SMILES
COc1ccc(-c2cc3c(c4c2OP(=O)(O)Oc2c(-c5ccc(OC)cc5)cc5c(c2-4)CCCC5)CCCC3)cc1- InChIKey
SXEMSRLLFMNTLD-UHFFFAOYSA-N- 분자식
- C34H33O6P
- 평균 분자량
- 568.6 g/mol
이름 및 식별자
- 우선 이름
- (11BS)-4-hydroxy-2,6-bis(4-methoxyphenyl)-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide
- IUPAC
- 13-hydroxy-10,16-bis(4-methoxyphenyl)-12,14-dioxa-13λ5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(23),2,8,10,15,17-hexaene 13-oxide
- 영어명
- (R)-4-oxide-2,6-bis[4-(4-methoxyphenyl)--8,9,10,11,12,13,14,15-octahydro-4-hydroxydinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin
- 분자식
- C34H33O6P
- 분자량
- 568.61
이름 및 동의어
1011465-27-2(11BS)-4-hydroxy-2,6-bis(4-methoxyphenyl)-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide2635339-85-2(11bR)-8,9,10,11,12,13,14,15-Octahydro-4-hydroxy-2,6-bis(4-methoxyphenyl)-4-oxide-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin(11bR)-4-Hydroxy-2,6-bis(4-methoxyphenyl)-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide(11bR)-8,9,10,11,12,13,14,15-Octahydro-4-hydroxy-2,6-bis(4-methoxyphenyl)-4-oxide-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin, 98% (99% ee)(11bR)?-8,?9,?10,?11,?12,?13,?14,?15-?Octahydro-?4-?hydroxy-?2,?6-?bis(4-?methoxyphenyl)?-4-?oxide-dinaphtho[2,?1-?d:1',?2'-?f]?[1,?3,?2]?dioxaphosphepin(11bS)-8,9,10,11,12,13,14,15-Octahydro-4-hydroxy-2,6-bis(4-methoxyphenyl)-4-oxide-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin13-hydroxy-10,16-bis(4-methoxyphenyl)-12,14-dioxa-13lambda5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(23),2,8,10,15,17-hexaene 13-oxide4-Hydroxy-2,6-bis(4-methoxyphenyl)-8,9,10,11,12,13,14,15-octahydrodinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide
물성
구조 계산 물성
- XLogP
- 8.3
- 극성 표면적
- 74.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 41
- 형식 전하
- 0
- 복잡도
- 858
물리화학적 성질
- 녹는점
- 241 · 241-243 °C (decomp)
- 끓는 점
- 780.4 · 780.4±70.0 °C(Predicted)
- 밀도
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- 저장 조건
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- 산도 계수 (pKa)
- 1.14 · 1.14±0.20(Predicted)
화학 및 산업
공급사21 곳
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
北京绿百草科技发展有限公司010-61136123 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
天津狄克特科技有限公司22-58627059 13920586291 · [email protected]
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [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18916372613 · [email protected]
小辣椒试剂021-60702684 18516024827 · [email protected]
Shanghai Daken Advanced Materials Co.,Ltd+86-2158073036 · [email protected]
上海安屹诺生物医药科技有限公司021-34625901 · [email protected]
上海燧伏化工科技有限公司33738187 19945655289 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
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