기본 정보
- CAS
181227-48-5- 표준 SMILES
CC(C)(C)OC(=O)N[C@@H](C(=O)O)C1Cc2ccccc2C1- InChIKey
VCHHRDDQOOBPTC-CYBMUJFWSA-N- 분자식
- C16H21NO4
- 평균 분자량
- 291.34 g/mol
- 단동위원소 질량
- 291.14705815
개요
See other relationships...
이름 및 식별자
- 우선 이름
- (R)-2-((tert-Butoxycarbonyl)amino)-2-(2,3-dihydro-1H-inden-2-yl)acetic acid
- IUPAC
- (2R)-2-(2,3-dihydro-1H-inden-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
- 영어명
- Boc-D-(2-inda)Gly-OH
- 분자식
- C16H21NO4
- 분자량
- 291.34
이름 및 동의어
181227-48-5Boc-D-Igl-OH(R)-2-((tert-Butoxycarbonyl)amino)-2-(2,3-dihydro-1H-inden-2-yl)acetic acid(r)-2-(tert-butoxycarbonylamino)-2-(2,3-dihydro-1h-inden-2-yl)acetic acidMFCD00671401(2R)-2-(2,3-dihydro-1H-inden-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic AcidDTXSID30458853(2R)-2,3-dihydro-1H-inden-2-yl({[(1,1-dimethylethyl)-oxy]carbonyl}amino)ethanoic acid(2R)-2,3-Dihydro-1H-inden-2-yl({[(1,1-dimethylethyl)oxy]carbonyl}amino)ethanoic acid1H-Indene-2-acetic acid, alpha-[[(1,1-dimethylethoxy)carbonyl]amino]-2,3-dihydro-, (alphaR)-Boc-d-(2-inda)gly-ohSCHEMBL1598690
이름 더 보기
BOC-D-INDANYLGLY-OHBOC-D-2-INDANYGLYCINEBoc-D-β-indanylglycineBOC-D-2-INDANYLGLYCINEBOC-D-(2-INDANYL)GLY-OHN-Boc-R-(2-Indanyl)glycineBOC-D-ALPHA-INDANYLGLYCINEBOC-D-(2-INDA)GLY-OH USP/EP/BP
(2R)-2-{[(tert-butoxy)carbonyl]amino}-2-(2,3-dihydro-1H-inden-2-yl)acetic acidVCHHRDDQOOBPTC-CYBMUJFWSA-NAKOS025312271AS-39967CS-0328470F470007(2R)-2,3-Dihydro-1H-inden-2-yl({[(1,1-dimethylet(2R)-2-(tert-butoxycarbonylamino)-2-indan-2-yl-acetic acid
데이터베이스 식별자
- CAS
181227-48-5- PubChem CID
- 11208543
- DTXSID
DTXSID30458853
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 75.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 388
물리화학적 성질
- 끓는 점
- 470.9 · 470.9±28.0 °C(Predicted)
- 밀도
- 1.195 · 1.195±0.06 g/cm3(Predicted)
- 저장 조건
- 0 °C · Store at 0°C
- 산도 계수 (pKa)
- 3.91 · 3.91±0.10(Predicted)
화학적 성질
White to off-white powder
안전 및 규제
안전 데이터
- 위험 등급
- IRRITANT
화학 및 산업
상·하류 제품 정보
상류 원료
공급사23 곳
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