기본 정보
- CAS
67436-13-9- 표준 SMILES
CC(C)(C)SCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O- InChIKey
IXAYZHCPEYTWHW-UHFFFAOYSA-N- 분자식
- C22H25NO4S
- 평균 분자량
- 399.5 g/mol
- 단동위원소 질량
- 399.15042945
이름 및 식별자
- 우선 이름
- N(alpha)-Fluorenylmethyloxycarbonyl-S-tert-butylcysteine
- IUPAC
- 3-tert-butylsulfanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
- 영어명
- Fmoc-Cys(tBu)-OH
- 분자식
- C22H25NO4S
- 분자량
- 399.51
이름 및 동의어
Fmoc-S-tert-butyl-cysNSC 334299L-Cysteine, S-(1,1-dimethylethyl)-N-((9H-fluoren-9-ylmethoxy)carbonyl)-N(alpha)-Fluorenylmethyloxycarbonyl-S-tert-butylcysteineRefChem:16083267436-13-9Fmoc-S-tert-butyl-L-cysteine3-tert-butylsulfanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acidFmoc-S-t-butyl-D-cysteineNSC334299Fmoc-S-t-butyl-L-cysteineSCHEMBL1491458
이름 더 보기
FMoc-Cys(tBu)FMOC-L-CYS(TBU)-OHFMOC-CYS(TBU)-OHFMOC-CYS(BUT)-OHFMOC-L-CYS(T-BU)FMOC-CYSTEINE(TBU)-OHFMOC-(S)-T-BUTYL-L-CYSFMOC-CYS(TBU)-OH, 98+%FMOC-(S)-TERT-BUTYL-L-CYS
AKOS024374939NSC-334299PD196645DB-042055ST51015002Fmoc-S-t-butyl-L-cysteine;Fmoc-Cys(tBu)-OH3-(tert-butylthio)-2-[(fluoren-9-ylmethoxy)carbonylamino]propanoic acid
데이터베이스 식별자
- CAS
67436-13-9
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 101 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 539
물리화학적 성질
- 녹는점
- 136 to · 136.0 to 140.0 °C
- 끓는 점
- 603.4 · 603.4±55.0 °C(Predicted)
- 밀도
- 1.237 · 1.237±0.06 g/cm3(Predicted)
- 저장 조건
- 2 · 2-8°C
- 수용성
- 물에 용해됨
- 용해도
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- 물리적 상태
- 결정성 분말
- 산도 계수 (pKa)
- 3.49 · 3.49±0.10(Predicted)
- 색상
- 하얀색
- BRN
- 4577031 · 4577031
- 주요 응용
- 펩타이드 합성
- InChI
- 1S/C22H25NO4S/c1-22(2,3)28-13-19(20(24)25)23-21(26)27-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,12-13H2,1-3H3,(H,23,26)(H,24,25)/t19-/m0/s1
- InChIKey
- IXAYZHCPEYTWHW-IBGZPJMESA-N
- SMILES
- CC(C)(C)SC[C@H](NC(=O)OCC1c2ccccc2-c3ccccc13)C(O)=O
화학적 성질
White solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
안전 데이터
- wgk
- 3
- HS 번호
- 2930 90 16
- safety_code
- 22-24/25
- 위험 등급
- IRRITANT
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도Fmoc-Cys(tBu)-OH, is an amino acid building block used in peptide synthesis. With a growing peptide drug market the fast, reliable synthesis of peptides is of great importance.
상·하류 제품 정보
상류 원료
공급사100 곳
北京华美互利生物化工010-56205725 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
上海康朗生物科技有限公司
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