(2S,3R)-3-Hydroxypyrrolidine-2-carboxylic acid, N-BOC protected

HCID 11096439

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 186132-80-9
표준 SMILES: CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H]1C(=O)O
InChIKey: JLDHXHPQMBNKMC-RQJHMYQMSA-N
분자식: C10H17NO5
평균 분자량: 231.25 g/mol
단동위원소 질량: 231.11067264

이름 및 식별자

우선 이름: (2S,3R)-3-Hydroxypyrrolidine-2-carboxylic acid, N-BOC protected
IUPAC: (2S,3R)-3-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
영어명: 1,2-Pyrrolidinedicarboxylic acid, 3-hydroxy-, 1-(1,1-dimethylethyl) ester, (2R,3S)-rel-
분자식: C10H17NO5
분자량: 231.25

이름 및 동의어

(2S,3R)-3-Hydroxypyrrolidine-2-carboxylic acid, N-BOC protectedRefChem:398781814-501-4186132-96-7Boc-cis-3-hydroxy-l-proline(2S,3R)-1-(tert-Butoxycarbonyl)-3-hydroxypyrrolidine-2-carboxylic acidMFCD08458682(2S,3R)-1-[(tert-butoxy)carbonyl]-3-hydroxypyrrolidine-2-carboxylic acidcis-1-(Tert-butoxycarbonyl)-3-hydroxypyrrolidine-2-carboxylic acid(2S,3R)-3-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic Acid186132-80-9(2S,3R)-1-BOC-3-hydroxypyrrolidine-2-carboxylic acid

이름 더 보기

cis-1-Boc-3-hydroxypyrrolidine-2-carboxylic Acidcis-1-tert-butoxycarbonyl-3-hydroxy-pyrrolidine-2-carboxylic acidcis-3-Hydroxy-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl esterrac-(2R,3S)-1-[(tert-Butoxy)carbonyl]-3-hydroxypyrrolidine-2-carboxylic acid(2R,3S)-rel-1-[(tert-butoxy)carbonyl]-3-hydroxypyrrolidine-2-carboxylic acidrac-(2R,3S)-1-[(tert-butoxy)carbonyl]-3-hydroxypyrrolidine-2-carboxylic acid, cis1,2-Pyrrolidinedicarboxylic acid, 3-hydroxy-, 1-(1,1-dimethylethyl) ester, (2R,3S)-rel-

N-t-BOC-cis-3-Hydroxy-L-Proline1,2-Pyrrolidinedicarboxylicacid,3-hydroxy-,1-(1,1Boc-cis-3-OH-Pro-OHSCHEMBL694280N-boc-cis-3-hydroxy-L-prolinecis-N-Boc-3-hydroxy-L-prolineDTXSID00455091JLDHXHPQMBNKMC-RQJHMYQMSA-N

데이터베이스 식별자

CAS: 186132-80-9、186132-96-7
PubChem CID: 11096439
DTXSID: DTXSID00455091
EC Number: 814-501-4、846-072-4
Nikkaji: J791.992A

물성

구조 계산 물성

XLogP: 0.8
극성 표면적: 87.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 5
회전 가능 결합 수: 3
무거운 원자 수: 16
형식 전하: 0
복잡도: 296

물리화학적 성질

녹는점: 124 · 124-125 °C (decomp)
끓는 점: 390.9 · 390.9±42.0 °C(Predicted)
밀도: 1.312 · 1.312±0.06 g/cm3(Predicted)
산도 계수 (pKa): 3.69 · 3.69±0.40(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 6건

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.

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

유해성 정보

Hazard Classes and Categories · 2건

Skin Irrit. 2 (100%)

안전 데이터

신호 어: Warning
유해·위험 문구: 암호 유해·위험 문구 위험 등급 범주 신호 어 그림 문자 P- 코드 H302

화학 및 산업

공급사67 곳

Zhengzhou Anhuida Chemical Co., Ltd+86-15903659408 · [email protected]

上海康恩博医药科技有限公司17510465506 · [email protected]

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

杭州品高化工有限公司0571-87658025 · [email protected]

西安华瑞致远生物科技有限公司18014474522 · [email protected]

화합물 노트

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