기본 정보
- CAS
2757287-50-4- 표준 SMILES
COc1c(C(C)(C)C)cc(-c2cc3ccccc3c3c2OP(=O)(O)Oc2c(-c4cc(C(C)(C)C)c(OC)c(C(C)(C)C)c4)cc4ccccc4c2-3)cc1C(C)(C)C- InChIKey
BRFHWVKCVFCDNX-UHFFFAOYSA-N- 분자식
- C50H57O6P
- 평균 분자량
- 785 g/mol
이름 및 식별자
- 우선 이름
- (11bR)-2,6-bis[3,5-bis(1,1-diMethylethyl)-4-Methoxyphenyl]-4-hydroxy-4-oxide-Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin
- IUPAC
- 10,16-bis(3,5-ditert-butyl-4-methoxyphenyl)-13-hydroxy-12,14-dioxa-13λ5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide
- 영어명
- Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin, 2,6-bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]-4-hydroxy-, 4-oxide, (11bS)-
- 분자식
- C50H57O6P
- 분자량
- 784.97
이름 및 동의어
957790-93-1(11bR)-2,6-bis[3,5-bis(1,1-diMethylethyl)-4-Methoxyphenyl]-4-hydroxy-4-oxide-Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin2757287-50-4(11bS)-2,6-Bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]-4-hydroxy-4-oxide-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepinMFCD31747023(11bS)-2,6-Bis(3,5-di-tert-butyl-4-methoxyphenyl)-4-hydroxydinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide(11BR)-2,6-bis(3,5-di-tert-butyl-4-methoxyphenyl)-4-hydroxydinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepine 4-oxide(11bR)-2,6-Bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]-4-hydroxy-4-oxide-dinaphtho[2,1-d:1'',2''-f][1,3,2]dioxaphosphepin(11bR)-2,6-Bis[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl]-4-hydroxy-4-oxide-dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin, 98%, (99% ee)(11bR)-26-Bis[35-bis(11-dimethylethyl)-4-methoxyphenyl]-4-hydroxy-4-oxide-dinaphtho[21-d:1'2'-f][132]dioxaphosphepin10,16-bis(3,5-ditert-butyl-4-methoxyphenyl)-13-hydroxy-12,14-dioxa-13lambda5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene 13-oxide
물성
구조 계산 물성
- XLogP
- 14.7
- 극성 표면적
- 74.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 57
- 형식 전하
- 0
- 복잡도
- 1,270
물리화학적 성질
- 끓는 점
- 860.7 · 860.7±75.0 °C(Predicted)
- 밀도
- 1.21 · 1.21±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 1.12 · 1.12±0.20(Predicted)
화학 및 산업
공급사10 곳
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
山东大有药物研发有限公司[email protected] 15165037910 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [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]
上海凯睿生物科技有限公司021-5068 3667/17749785980/1029026415; 17749785980 · [email protected]
上海安屹诺生物医药科技有限公司021-34625901 · [email protected]
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
都创（上海）医药科技股份有限公司021-58099077-8041 18601625411 · [email protected]
扬州摩笛尔电子材料有限公司13761402923 19975033992 · [email protected]
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