2-(BocaMino)피리딘-4-보론산피나콜에스테르

tert-butyl N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate

HCID 49760449

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1095708-32-9
표준 SMILES: CC(C)(C)OC(=O)Nc1cc(B2OC(C)(C)C(C)(C)O2)ccn1
InChIKey: SAAGMIHGVLKZBC-UHFFFAOYSA-N
분자식: C16H25BN2O4
평균 분자량: 320.2 g/mol
단동위원소 질량: 320.19073768

이름 및 식별자

우선 이름: tert-butyl N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamate
IUPAC: tert-butyl N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]carbamate
현지명: 2-(BocaMino)피리딘-4-보론산피나콜에스테르
영어명: tert-Butyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin -2-yl]carbamate
분자식: C16H25BN2O4
분자량: 320.19

이름 및 동의어

tert-butyl N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamatetert-butyl N-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamateRefChem:896051863-168-11095708-32-9tert-Butyl (4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamatetert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-ylcarbamate2-(tert-Butoxycarbonylamino)pyridine-4-boronic acid pinacol esterMFCD12032217tert-butyl N-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamate2-(BOC-AMINO)PYRIDINE-4-BORONIC ACID PINACOL ESTERBoc-2-Aminopyridine-4-boronic acid pinacol ester

이름 더 보기

2-(BocaMino)피리딘-4-보론산피나콜에스테르2-boc-aminopyridine-4-borate frequency alcohol ester2-(tert-Butoxycarbonylamino)pyridine-4-boronic acid pinacol ...(2-((TERT-BUTOXYCARBONYL)AMINO)PYRIDIN-4-YL)BORONIC ACID PINACOL ESTER2-(tert-Butoxycarbonylamino)pyridine-4-boronic acid pinacol ester - [A12056]N-tert-butyl-N-[3-(tetraMethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbaMateert-Butyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin -2-yl]carbamatetert-Butyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin -2-yl]carbamate

tert-Butyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridintert-Butyl [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamatetert-Butyl[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]carbamateBoc-2-Aminopyrtert-Butyl(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)carbamateSAAGMIHGVLKZBC-UHFFFAOYSA-NSCHEMBL9979047SCHEMBL29393739

데이터베이스 식별자

CAS: 1095708-32-9
PubChem CID: 49760449
DTXSID: DTXSID30678211
EC Number: 863-168-1

물성

구조 계산 물성

극성 표면적: 69.7 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 4
무거운 원자 수: 23
형식 전하: 0
복잡도: 432

물리화학적 성질

끓는 점: 400.7 · 400.7±30.0 °C(Predicted)
밀도: 1.1 · 1.10
저장 조건: -20 °C · Sealed in dry,Store in freezer, under -20°C
산도 계수 (pKa): 12.66 · 12.66±0.70(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.