N-Boc-D-serine methyl ester

HCID 377723CAS 95715-85-8

기본 정보

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

이름 및 식별자

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

이름 및 동의어

N-BOC-D-Serine methyl esterRefChem:829332810-610-695715-85-8BOC-D-SER-OMEBOC-D-Serine methyl esterN-(tert-Butoxycarbonyl)-D-serine methyl ester(R)-methyl 2-(tert-butoxycarbonylamino)-3-hydroxypropanoateMFCD00270516(R)-Methyl 2-((tert-butoxycarbonyl)amino)-3-hydroxypropanoatemethyl (2R)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoateMETHYL N-BOC-D-SERINATE

이름 더 보기

)-D-serine methyLBoc-D-Ser-OMe(Oil)N-BOC-D-ser-methylesterN-D-serine methyl esterN-BOC-D-serine methylesterN-FmocD-serine methylester

D-Serine, N-[(1,1-dimethylethoxy)carbonyl]-, methyl estermethyl (2R)-2-(tert-butoxycarbonylamino)-3-hydroxy-propanoateMethyl (tert-butoxycarbonyl)-D-serinateAC-24070PD196118methyl (2R)-2-{[(tert-butoxy)carbonyl]amino}-3-hydroxypropanoateN-tert-Butoxycarbonyl-D-Serine Methyl EsterB4859

데이터베이스 식별자

CAS: 95715-85-8
PubChem CID: 377723
DTXSID: DTXSID00327481
UNII: BB6YGX76JZ
EC Number: 810-610-6
Nikkaji: J1.410.241H

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: 215 °C · 215 °C(lit.)
밀도: 1.08 g/mL · 1.08 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.453(lit.)
인화점: 230 °F · >230 °F
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: 클로로포름, 메탄올에 용해됨
물리적 상태: 액체
산도 계수 (pKa): 10.7 · 10.70±0.46(Predicted)
색상: 무색~황색
주요 응용: 펩타이드 합성
InChI: 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-/m1/s1
InChIKey: SANNKFASHWONFD-ZCFIWIBFSA-N
SMILES: C(OC)(=O)[C@@H](CO)NC(OC(C)(C)C)=O

화학적 성질

colorless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.

Warning

H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 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 CategoriesSkin Irrit. 2 (66.7%)

안전 데이터

wgk: 3
HS 번호: 29241990
risk_code: 36/37/38
safety_code: 26-36/37/39
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

응용 분야

용도Protected D-Serine.

상·하류 제품 정보

상류 원료

하류 제품

N-Boc-(S)-2-amino-3-hydroxy-3-methylbutanoic acid (R)-Methyl 2-((Tert-Butoxycarbonyl)Amino)-3-((Tert-Butyldimethylsilyl)Oxy)Propanoate

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]

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]

韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]

연결된 노트

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