4-Piperidinecarboxamide (HCID 3772)

이름 및 식별자

우선 이름: 4-Piperidinecarboxamide
IUPAC: piperidine-4-carboxamide
현지명: 4-피퍼리딘카르복사미드
영어명: Isonipecotamide
분자식: C6H12N2O
분자량: 128.17

이름 및 동의어

Piperidine-4-carboxamideIsonipecotamide39546-32-24-Piperidinecarboxamide4-carbamoylpiperidine4-piperidine carboxamideCZE2810T4X4-carboxamidopiperidinePiperidine-4-carboxylic acid amideEINECS 254-501-6NSC 82318NSC-82318

이름 더 보기

4-피퍼리딘카르복사미드헥사히드로이소니코틴아미드PIPERIDINE-4-CARBALDEHYDEIsonipectoamideIsonepicotamideIsonipecotinamideIsonipecotamide>

4-(aminocarbonyl)piperidine4-PIPERIDYLCARBOXAMIDEDTXSID7068182RefChem:526499DTXCID0039643HexahydroisonicotinamideMFCD00038012iso-nipecotamide

데이터베이스 식별자

CAS: 39546-32-2
PubChem CID: 3772
DTXSID: DTXSID7068182
ChEMBL: CHEMBL184430
ChEBI: CHEBI:166563
UNII: CZE2810T4X
EC Number: 254-501-6
Nikkaji: J208.629H

물성

구조 계산 물성

XLogP: -1.4
극성 표면적: 55.1 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 108

물리화학적 성질

녹는점: 145 · 145-148 °C(lit.)
끓는 점: 237.61 °C · 237.61°C (rough estimate)
밀도: 1.0754 · 1.0754 (rough estimate)
굴절률: 1.488 · 1.4880 (estimate)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
용해도: DMSO(적게), 메탄올(약간)에 용해됨
물리적 상태: 결정성 분말
산도 계수 (pKa): 16.48 · 16.48±0.20(Predicted)
색상: 흰색에서 밝은 노란색
수용성: 물에 용해됩니다.
BRN: 112554 · 112554
안정성: 흡습성
InChI: 1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)
InChIKey: DPBWFNDFMCCGGJ-UHFFFAOYSA-N
SMILES: NC(=O)C1CCNCC1
LogP: -0.88 · -0.88
EPA: 4 · 4-Piperidinecarboxamide (39546-32-2)

화학적 성질

WHITE TO LIGHT YELLOW CRYSTALLINE POWDER

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (98.1%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 53 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory InformationStatus: Active Update: 21-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21793

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (98.1%)

규제 정보

Regulatory InformationStatus: Active Update: 21-12-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/21793

안전 데이터

wgk: 3
tsca: TSCA listed
HS 번호: 29339900
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39-36
위험 참고 사항: Irritant
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing Information4-Piperidinecarboxamide: ACTIVE

응용 분야

용도Anesthetic, analgesic, antimicrobial and cooling agent for prevention or treatment of skin irritation.

상·하류 제품 정보

하류 제품

tert-Butyl 4-(4-formyl-1,3-thiazol-2-yl)tetrahydro-1(2H)-pyridinecarboxylate 4-아미노-1-벤질피페리딘 tert-Butyl 4-(5-formyl-4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxylate 1-메틸-피페리딘-4-탄소니트릴 (1-메틸-4-피페리디닐)메탄아민 1-Boc-4-시아노피페리딘 tert-부틸4-(아미노카르보티오일)테트라히드로피리딘-1(2H)-카르복실레이트 4-(아미노메틸)피페리딘 4-(Boc-아미노메틸)피페리딘 TERT-부틸4-(아미노카보닐)테트라하이드로피리딘-1(2H)-카복실레이트 1-(3,5-Dichloropyridin-4-yl)piperidine-4-carboxamide 1-(2-하이드록시-에틸)-피페리딘-4-카르복실산아미드

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

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

INTATRADE GmbH+49 3493/605464 · [email protected]

연결된 노트

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4-피퍼리딘카르복사미드

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