2,2-dimethyl-N-(pyridin-3-yl)propanamide

HCID 4655044CAS 70298-88-3

기본 정보

표준 SMILES: CC(C)(C)C(=O)Nc1cccnc1
InChIKey: VQXVCVTZSTYIMG-UHFFFAOYSA-N
분자식: C10H14N2O
평균 분자량: 178.23 g/mol
단동위원소 질량: 178.11061307

이름 및 식별자

우선 이름: 2,2-dimethyl-N-(pyridin-3-yl)propanamide
IUPAC: 2,2-dimethyl-N-pyridin-3-ylpropanamide
영어명: 2,2-Dimethyl-N-pyridin-3-yl-propionamide
분자식: C10H14N2O
분자량: 178.23

이름 및 동의어

70298-88-32,2-dimethyl-N-(pyridin-3-yl)propanamideDTXSID10405289RefChem:243550DTXCID703561422,2-Dimethyl-N-pyridin-3-yl-propionamide2,2-Dimehtyl-N-pyridin-3-yl-propionamideN-(PYRIDIN-3-YL)PIVALAMIDE2,2-dimethyl-N-pyridin-3-ylpropanamideMFCD009962432,2-DIMETHYL-N-(3-PYRIDYL)PROPIONAMIDE2,2-dimethyl-N-(3-pyridinyl)propanamide

이름 더 보기

Zinc04352664N-(3-Pyridyl)pivalamide>N-(3-Pyridyl)pivalamide, 95%2,2-Dimethyl-N-3-pyridinyl-propanamide

SCHEMBL3916833-(PIVALOYLAMINO)PYRIDINEEN300-1407072,2-dimethyl-N-(3-pyridyl)propanamidePROPANAMIDE, 2,2-DIMETHYL-N-3-PYRIDINYL-n-3-pyridylpivalamide2,2-Dimethyl-N-pyridine-3yl-propionamideN-(3-Pyridyl)pivalamide

데이터베이스 식별자

CAS: 70298-88-3
PubChem CID: 4655044
DTXSID: DTXSID10405289
EC Number: 679-008-7
Nikkaji: J1.467.138B

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 42 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 13
형식 전하: 0
복잡도: 184

물리화학적 성질

녹는점: 129 · 129-131℃
끓는 점: 337.5 · 337.5±15.0 °C(Predicted)
밀도: 1.078 · 1.078±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
용해도: 메탄올에 용해됨
물리적 상태: powder to crystal
산도 계수 (pKa): 14.19 · 14.19±0.70(Predicted)
색상: White to Light yellow to Light orange

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, P304+P340, P305+P351+P338, P319, P330, P337+P317, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.