Guidechem | China Chemical Manufacturers,suppliers,B2B Marketplace RFQ 게시 |
홈페이지> 백과사전 >약품 중간체>유기 중간체>Others

카르보네이트-L-디산-아카테네이트

IUPAC이름:tert-butyl (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-hydroxyphenyl)propanoate
CAS 레지스트리 번호: 133852-23-0
분자량:459.5
1. 이름 및 식별자
1.1 제품명
카르보네이트-L-디산-아카테네이트
1.2 동의어

1.3 CAS 레지스트리 번호
133852-23-0
1.4 CID
15295906
1.5 분자식
C28H29NO5 (isomer)
1.6 Inchi
InChI=1S/C28H29NO5/c1-28(2,3)34-26(31)25(16-18-12-14-19(30)15-13-18)29-27(32)33-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25,30H,16-17H2,1-3H3,(H,29,32)/t25-/m0/s1
1.7 InchiKey
VJSGNJOUWWMJDE-VWLOTQADSA-N
1.8 교회법에 의거 한 SMILES
CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
1.9 이성질체 SMILES
CC(C)(C)OC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
2. 속성
2.1 밀도
1.219±0.06 g/cm3(Predicted)
2.2 비등점
655.9±55.0 °C(Predicted)
2.3 굴절 인덱스
1.601 (Predicted)
2.4 번쩍이는 점
350.5±31.5 °C (Predicted)
2.5 PSA
84.86000
2.6 logP
5.57460
2.7 가용성
Insuluble (3.8E-4 g/L) (25 oC),
2.8 pKa
9.75±0.15(Predicted)
3. NMR 스펙트럼
4. 화학 데이터 계산
  • 분자량: 459.5g/mol
  • 분자식: C28H29NO5
  • Compound Is Canonicalized: True
  • XLogP3-AA: 5.6
  • Exact Mass: 459.20457303
  • Monoisotopic Mass: 459.20457303
  • Complexity: 673
  • Rotatable Bond Count: 9
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Topological Polar Surface Area: 84.9
  • Heavy Atom Count: 34
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count: 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 1
  • CACTVS Substructure Key Fingerprint: AAADceB6OAAAAAAAAAAAAAAAAAAAAYAAAAAwYMAAAAAAAGABUAAAHgAQCAAADWzhmAYyDoLABgCIAiDSGAACAAAgIAAIiIGOCIkKJjKCkTOPcAAk1hEYmAeYyPCOoAAAAAAQAABAAAAAACAAAQAACAAAAA==
5. 권장 공급업체
Global59공급자모두 보기 >>
  • Products:Custom synthesis,Tailor-made Procurement
  • Tel:15013857715
Fmoc-Tyr-OtBu
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2026/08/03
Inquire
Fmoc-Tyr-OtBu 133852-23-0
  • Purity:99%Packing: 200kg/bag FOB
  • Price: 20 USD/kilogram
  • Time: 2025/08/05
Inquire
  • Tel:+44 (0)2036089360-31
Fmoc-Tyr-OtBu
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2019/02/25
Inquire
  • Products:custom peptides, catalogue peptides, pharmaceutical peptides, cosmetic peptides,monoclonal antibody, polyclonal antibody,FMOC-ARG(PBF)-OH,FMOC-LYS(ME.BOC)-OH
  • Tel:86-21-61263452
Fmoc-Tyr-OtBu
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2016/04/14
Inquire
  • Tel:021-61263310
Fmoc-Tyr-OtBu
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2019/03/29
Inquire
6. 실제 제품 정보