N-Boc-L-serine methyl ester

HCID 7019177CAS 2766-43-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: COC(=O)[C@H](CO)NC(=O)OC(C)(C)C
InChIKey: SANNKFASHWONFD-LURJTMIESA-N
분자식: C9H17NO5
평균 분자량: 219.23 g/mol
단동위원소 질량: 219.11067264

개요

structure in first source

이름 및 식별자

우선 이름: N-Boc-L-serine methyl ester
IUPAC: methyl (2S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
영어명: Boc-L-serine methyl ester
분자식: C9H17NO5
분자량: 219.24

이름 및 동의어

2766-43-0N-(tert-Butoxycarbonyl)-L-serine methyl esterN-Boc-L-serine Methyl Ester7UGR7X7P8GN-tert-Butyloxycarbonyl-L-serine methyl esterRefChem:828690690-499-7Boc-Ser-OMeBoc-L-serine methyl esterBoc-L-Ser-OMe(S)-Methyl 2-((tert-butoxycarbonyl)amino)-3-hydroxypropanoateMFCD00191869

이름 더 보기

Boc-Ser-MeBOC-SERINE-OMEDL-(4-NO2)-PheBoc-DL-Ser.oMe

N-tert-butoxycarbonyl-L-serine Methyl Estermethyl (tert-butoxycarbonyl)-L-serinateL-Serine, N-[(1,1-dimethylethoxy)carbonyl]-, methyl estermethyl (2S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoatemethyl N-(tert-butoxycarbonyl)-L-serinateSCHEMBL313780N-Boc-(S)-serine methyl esterDTXSID30427089

데이터베이스 식별자

CAS: 2766-43-0
PubChem CID: 7019177
DTXSID: DTXSID30427089
ChEMBL: CHEMBL1222065
UNII: 7UGR7X7P8G
EC Number: 690-499-7
Nikkaji: J465.575C

물성

구조 계산 물성

XLogP: 0.2
극성 표면적: 84.9 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 5
회전 가능 결합 수: 6
무거운 원자 수: 15
형식 전하: 0
복잡도: 233

물리화학적 성질

끓는 점: 354.3 · 354.3±32.0 °C(Predicted)
밀도: 1.082 g/mL · 1.082 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.452(lit.)
인화점: 230 °F · >230 °F
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
산도 계수 (pKa): 10.7 · 10.70±0.46(Predicted)
물리적 상태: 액체 또는 오일
색상: 무색~황색
수용성: 물에 약간 용해됩니다.
BRN: 3545389 · 3545389
주요 응용: 펩타이드 합성
InChI: 1S/C9H17NO5/c1-9(2,3)15-8(13)10-6(5-11)7(12)14-4/h6,11H,5H2,1-4H3,(H,10,13)/t6-/m0/s1
InChIKey: SANNKFASHWONFD-LURJTMIESA-N
SMILES: COC(=O)[C@H](CO)NC(=O)OC(C)(C)C

화학적 성질

Liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 50% (2 of 4) of reports.

Danger

H225 (25%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P203, P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesFlam. Liq. 2 (25%)

안전 데이터

wgk: 3
HS 번호: 29241990
safety_code: 23-24/25
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야 · 1건

용도Boc-L-serine methyl ester is a derivative of L-Serine Methyl Ester Hydrochloride (S271005) derivative. Boc-L-serine methyl ester is an amino acid derivative used in the preparation of Tn antigen, L-glutamic acid p-nitroanilide analogs and new biomedical polymers having Serine and Threonine side groups.

상·하류 제품 정보

상류 원료

하류 제품

L-세린메틸에스테르 (S)-4-Boc-morpholine-3-carboxylic acid N-Boc-(S)-2-amino-3-hydroxy-3-methylbutanoic acid (S)-3-Boc-아미노-감마-부티로락톤 Boc-D-leucinol 카르밤산,[(1R)-1-(히드록시메틸)프로필]-,1,1-디메틸에틸에스테르(9CI)Boc-Nva-OH Boc-Ser(Me)-OH 카르밤산,[(1R)-2-클로로-1-(히드록시메틸)에틸]-,1,1-디메틸에틸에스테르

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

T&W GROUP021-61551611 13296011611 · [email protected]

연결된 노트

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