기본 정보
- CAS
174286-31-8- 표준 SMILES
CC(C)(C)OC(=O)N1CCC(C(=O)O)CC1- InChIKey
JWOHBPPVVDQMKB-UHFFFAOYSA-N- 분자식
- C11H19NO4
- 평균 분자량
- 229.27 g/mol
이름 및 식별자
- 우선 이름
- 1-(tert-Butoxycarbonyl)-4-piperidinecarboxylic acid
- IUPAC
- 1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
- 현지명
- 1-(tert-부톡시카르보닐)피페리딘-4-카르복시산
- 영어명
- 1-(Tert-butoxycarbonyl)piperidine-4-carboxylid acid
- 분자식
- C11H19NO4
- 분자량
- 229.28
이름 및 동의어
84358-13-4N-BOC-piperidine-4-carboxylic acid1-Boc-piperidine-4-carboxylic acid1-(tert-Butoxycarbonyl)-4-piperidinecarboxylic acid1-[(Tert-Butoxy)Carbonyl]Piperidine-4-Carboxylic AcidAAZ2CAT47BNSC 6939241,4-Piperidinedicarboxylic acid, 1-(1,1-dimethylethyl) ester1-tert-butoxycarbonylisonipecotic acidNSC-693924N-(tert-butoxycarbonyl)isonipecotic acidpiperidine-1,4-dicarboxylic acid 1-tert-butyl ester
이름 더 보기
1-(tert-부톡시카르보닐)피페리딘-4-카르복시산1,4-piperidate-1-tert-butyl1,4-Piperidinedicarboxylic acid 1-tert-butyl ester1-(Tert-butoxycarbonyl)piperidine-4-carboxylid acid1,4-Piperidinedicarboxylic acid 1-tert-butyl ester, labeled with deuterium
DTXSID702333431-tert-butoxycarbonyl-4-piperidinecarboxylic acidn-tert-butoxycarbonyl-4-piperidinecarboxylic acidpiperidine-1,4-dicarboxylic acid mono-tert-butyl ester1-[(tert-butyl)oxycarbonyl]piperidine-4-carboxylic acid1-(1,1-Dimethylethoxycarbonyl)Piperidine-4-Carboxylic Acidn-(tert-butoxycarbonyl)isonipecotinic acidn-(tert-butyloxycarbonyl)isonipecotic acid
데이터베이스 식별자
- CAS
174286-31-8- ChEMBL
CHEMBL1730672- UNII
- AAZ2CAT47B
- EC Number
- 700-076-1
- Nikkaji
- J887.393C
물성
구조 계산 물성
- XLogP
- 1.1
- 극성 표면적
- 66.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 274
안전 및 규제
GHS 분류
GHS Classification
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)
Aggregated GHS information provided per 13 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationStatus: Active Update: 27-10-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/31799
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
화학 및 산업
공급사8 곳
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
上海平果医药科技有限公司021-20432229 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
广州市桐晖药业有限公司020-66392521-118 18922260391 · [email protected]
重庆卡兰医药有限公司[email protected]
上海盛袖生物科技有限公司13761144602 · [email protected]
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