(R)-2-((tert-부톡시카르보닐)아미노)-3-시클로프로필프로판산

(R)-2-((tert-Butoxycarbonyl)amino)-3-cyclopropylpropanoic acid

HCID 2756015

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 89483-08-9
표준 SMILES: CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)O
InChIKey: GKRRTFCDSZGFSZ-MRVPVSSYSA-N
분자식: C11H19NO4
평균 분자량: 229.27 g/mol
단동위원소 질량: 229.13140809

이름 및 식별자

우선 이름: (R)-2-((tert-Butoxycarbonyl)amino)-3-cyclopropylpropanoic acid
IUPAC: (2R)-3-cyclopropyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
현지명: (R)-2-((tert-부톡시카르보닐)아미노)-3-시클로프로필프로판산
영어명: (R)-2-((tert-butoxycarbonyl)aMino)-3-cyclopropylpropanoic acid
분자식: C11H19NO4
분자량: 229.27286

이름 및 동의어

89483-08-9(R)-2-((tert-Butoxycarbonyl)amino)-3-cyclopropylpropanoic acid(R)-2-(BOC-AMINO)-3-CYCLOPROPYLPROPANOIC ACIDMFCD08272865(R)-2-(Boc-amino)-3-cyclopropylpropionic acidCyclopropanepropanoic acid, a-[[(1,1-dimethylethoxy)carbonyl]amino]-,(aR)-N-(tert-butoxycarbonyl)-3-cyclopropyl-D-alanine(R)-2-((tert-Butoxycarbonyl)amino)-3-cyclopropylpropanoicacid(R)-2-(tert-butoxycarbonylamino)-3-cyclopropylpropanoic acid(alphaR)-alpha-[[(1,1-Dimethylethoxy)carbonyl]amino]cyclopropanepropanoic acid(2R)-2-{[(tert-butoxy)carbonyl]amino}-3-cyclopropylpropanoic acid(2R)-3-cyclopropyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

이름 더 보기

(R)-2-((tert-부톡시카르보닐)아미노)-3-시클로프로필프로판산Cyclopropanepropanoic acid, α-[[(1,1-dimethylethoxy)carbonyl]amino]-, (αR)-

N-Boc-R-3-CyclopropylalanineSCHEMBL1351322GKRRTFCDSZGFSZ-MRVPVSSYSA-NDTXSID401153602AKOS030524882AS-35656SY258199CS-0171844

데이터베이스 식별자

CAS: 89483-08-9
PubChem CID: 2756015
DTXSID: DTXSID401153602
EC Number: 182-998-9

물성

구조 계산 물성

XLogP: 2
극성 표면적: 75.6 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 6
무거운 원자 수: 16
형식 전하: 0
복잡도: 278

물리화학적 성질

끓는 점: 377.2 · 377.2±25.0 °C(Predicted)
밀도: 1.162 · 1.162±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
산도 계수 (pKa): 4 · 4.00±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): 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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.