Benzyloxycarbonylglycine

HCID 14349CAS 1138-80-3
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기본 정보

표준 SMILES
O=C(O)CNC(=O)OCc1ccccc1
InChIKey
CJUMAFVKTCBCJK-UHFFFAOYSA-N
분자식
C10H11NO4
평균 분자량
209.2 g/mol
단동위원소 질량
209.06880783

개요

N-benzyloxycarbonylglycine is a derivative of glycine having a benzyloxycarbonyl protecting group attached to the nitrogen. It is a conjugate acid of a N-benzyloxycarbonylglycinate.

이름 및 식별자

우선 이름
Benzyloxycarbonylglycine
IUPAC
2-(phenylmethoxycarbonylamino)acetic acid
영어명
N-Carbobenzyloxyglycine
분자식
C10H11NO4
분자량
209.2

이름 및 동의어

1138-80-3N-BenzyloxycarbonylglycineN-CBZ-glycineN-CarbobenzoxyglycineCarbobenzyloxyglycineCarbobenzoxyglycine(Cbz)glyBenzyloxycarbonylglycineGlycine, N-[(phenylmethoxy)carbonyl]-Z-Gly2-(phenylmethoxycarbonylamino)acetic acidCarbobenzoxyl glycine
이름 더 보기
Z-GLY-OHCBZ-GLY-OHZ-GLYCINECBZ-GLYCINE
N-Carboxyglycine N-benzyl esterN-((Phenylmethoxy)carbonyl)glycineCBZ-GLYNSC-2526Glycine, N-((phenylmethoxy)carbonyl)-8H79QYG43GDTXSID8061559CHEBI:16532

데이터베이스 식별자

CAS
1138-80-3
PubChem CID
14349
DTXSID
DTXSID8061559
ChEMBL
CHEMBL101287
ChEBI
CHEBI:16532
UNII
8H79QYG43G
EC Number
214-516-0
Nikkaji
J80.195J

물성

구조 계산 물성

XLogP
1
극성 표면적
75.6 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
5
무거운 원자 수
15

실험 및 물리화학적 성질

Chemical ClassesBiological Agents -> Amino Acids and Derivatives
LogP1.47
Physical DescriptionWhite powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
118 · 118-122 °C(lit.)
끓는 점
348.55 °C · 348.55°C (rough estimate)
밀도
1.2944 · 1.2944 (rough estimate)
굴절률
1.54 · 1.5400 (estimate)
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
0.1 g/mL, · 메탄올: 0.1 g/mL, 투명

화학적 성질

N-Carbobenzyloxyglycine is white to light yellow crystal powde

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 66.7% (6 of 9) of all reports.

Warning

H315 (33.3%): 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 9 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 16-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/27346

Glycine, N-(phenylmethoxy)carbonyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryAn irritant; Reproductive effects observed in experimental animals; [Alfa Aesar MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (33.3%)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
MB9129000
독성
mouse,LD50,intravaginal,380mg/kg (380mg/kg),Journal of Pharmaceutical Sciences. Vol. 68, Pg. 696, 1979.
HS 번호
29242995
risk_code
62-36/37/38-20/21/22

화학 및 산업

용도 및 제조

General Manufacturing InformationGlycine, N-[(phenylmethoxy)carbonyl]-: INACTIVE

응용 분야

용도N-Carbobenzoxyglycine is used in the dipeptide synthesis.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
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]
INTATRADE GmbH+49 3493/605464 · [email protected]

추가 설명

정의N-Carbobenzyloxyglycine is a derivative of glycine having a benzyloxycarbonyl protecting group attached to the nitrogen.

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