기본 정보
- CAS
178445-89-1- 표준 SMILES
COc1ccc(CCC(O)c2cccc(OCC(=O)OC(C)(C)C)c2)cc1OC- InChIKey
LTSMVCSYXYLQNM-UHFFFAOYSA-N- 분자식
- C23H30O6
- 평균 분자량
- 402.5 g/mol
- 단동위원소 질량
- 402.20423868
이름 및 식별자
- 우선 이름
- tert-Butyl {3-[3-(3,4-dimethoxyphenyl)-1-hydroxypropyl]phenoxy}acetate
- IUPAC
- tert-butyl 2-[3-[3-(3,4-dimethoxyphenyl)-1-hydroxypropyl]phenoxy]acetate
- 영어명
- R)-1-(3-(tert-butoxycarbonylmethoxy)phenyl)-3-(3,4-dimethoxyphenyl)-propan-1-ol
- 분자식
- C23H30O6
- 분자량
- 402.48
이름 및 동의어
tert-Butyl {3-[3-(3,4-dimethoxyphenyl)-1-hydroxypropyl]phenoxy}acetateTERT-BUTYL 2-(3-(3-(3,4-DIMETHOXYPHENYL)-1-HYDROXYPROPYL)PHENOXY)ACETATE2206365-06-0tert-butyl 2-[3-[3-(3,4-dimethoxyphenyl)-1-hydroxypropyl]phenoxy]acetateSCHEMBL15049104DTXSID90622654(R)-1-(3-(tert-butoxycarbonylmethoxy)phenyl)-3-(3,4-dimethoxyphenyl)-propan-1-olLTSMVCSYXYLQNM-UHFFFAOYSA-NAT47577DB-144928tert-butyl 2-[3-[3-(3,4-dimethoxyphenyl)-1-hydroxy-propyl]phenoxy]acetate1-(3-(tert-Butoxycarbonylmethoxy)phenyl)-3-(3,4-dimethoxyphenyl)propan-1-ol
이름 더 보기
(R)-tert-butyl 2-(3-(3-(3,4-dimethoxyphenyl)-1-hydroxypropyl)phenoxy)acetatetert-Butyl (R)-2-(3-(3-(3,4-dimethoxyphenyl)-1-hydroxypropyl)phenoxy)acetateR)-1-(3-(tert-butoxycarbonylmethoxy)phenyl)-3-(3,4-dimethoxyphenyl)-propan-1-olAcetic acid, 2-[3-[(1R)-3-(3,4-dimethoxyphenyl)-1-hydroxypropyl]phenoxy]-, 1,1-dimethylethyl ester
물성
구조 계산 물성
- XLogP
- 4.2
- 극성 표면적
- 74.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 29
- 형식 전하
- 0
- 복잡도
- 488
물리화학적 성질
- 끓는 점
- 521.1 · 521.1±50.0 °C(Predicted)
- 밀도
- 1.131 · 1.131±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C, sealed storage, away from moisture
- 산도 계수 (pKa)
- 14.1 · 14.10±0.20(Predicted)
화학 및 산업
공급사11 곳
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
学研惠（武汉）科技有限公司15727060112 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
上海德轩医药科技有限公司[email protected] · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
上海天习化工有限公司021-20960837,QQ1332204249 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
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