CAS 1092563-23-9 1-Morpholino-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanone (HCID 59392660)

기본 정보

CAS: 1092563-23-9
표준 SMILES: CC1(C)OB(c2ccc(CC(=O)N3CCOCC3)cc2)OC1(C)C
InChIKey: WPWLZNJSVHKWON-UHFFFAOYSA-N
분자식: C18H26BNO4
평균 분자량: 331.2 g/mol
단동위원소 질량: 331.1954885

이름 및 식별자

우선 이름: 1-Morpholino-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanone
IUPAC: 1-morpholin-4-yl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone
영어명: 1-(4-morpholinyl)-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-Ethanone
분자식: C18H26BNO4
분자량: 331.21

이름 및 동의어

1092563-23-91-Morpholino-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanoneMFCD189102771-morpholin-4-yl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone1-Morpholino-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethan-1-one1-(morpholin-4-yl)-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethan-1-one1-morpholino-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanonestarbld00169171-(4-morpholinyl)-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-EthanoneSCHEMBL578532WPWLZNJSVHKWON-UHFFFAOYSA-N1-(4-morpholinyl)-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]Ethanone

이름 더 보기

4-(morpholine-4-ylformylmethyl)benzeneboronic acidolesterEthanone, 1-(4-morpholinyl)-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-

DB-023733CS-0173825N11510F696233A1-092271-(morpholin-4-yl)-2-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone1-morpholin-4-yl-2-[4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-ethanone1-morpholin-4-yl-2-[4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)phenyl]ethanone

물성

구조 계산 물성

극성 표면적: 48 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 3
무거운 원자 수: 24
형식 전하: 0
복잡도: 438

물리화학적 성질

끓는 점: 496.8 · 496.8±45.0 °C(Predicted)
밀도: 1.12 · 1.12±0.1 g/cm3(Predicted)
산도 계수 (pKa): -0.9 · -0.90±0.20(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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

화학 및 산업

공급사12 곳

泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]

上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]

上海药禾平生物医药科技有限公司57540919 13120888836 · [email protected]

江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]

上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]

화합물 노트

불러오는 중…

1-Morpholino-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethanone