1-Piperidinecarboxaldehyde (HCID 17429)

개요

1-Piperidinecarboxaldehyde is a member of piperidines.

이름 및 식별자

우선 이름: 1-Piperidinecarboxaldehyde
IUPAC: piperidine-1-carbaldehyde
현지명: 포밀피페리딘
영어명: N-Formylpiperidine
분자식: C6H11NO
분자량: 113.16

이름 및 동의어

N-Formylpiperidine2591-86-8piperidine-1-carbaldehyde1-PiperidinecarboxaldehydeFormylpiperidinePiperidinoformamidePIPERIDINE, 1-FORMYL-DTXSID8043941ZIQ29H6CZGNSC-1066NSC-404158DTXCID6023941

이름 더 보기

포밀피페리딘1-폼일피페리딘N-포르밀피페리딘nfp1-FormyLN-Formylpiperdine1-formyl-piperidin

RefChem:830052219-986-01-FormylpiperidineN-Formylpiperidin1-PiperidinecarbaldehydePiperidine-N-carbaldehydePiperidine-1-carboxaldehydeN-Piperidinecarboxaldehyde

데이터베이스 식별자

CAS: 2591-86-8
PubChem CID: 17429
DTXSID: DTXSID8043941
ChEMBL: CHEMBL1232817
ChEBI: CHEBI:193610
UNII: ZIQ29H6CZG
EC Number: 219-986-0
Nikkaji: J77.422G

물성

구조 계산 물성

XLogP: 0
극성 표면적: 20.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 0
무거운 원자 수: 8
형식 전하: 0
복잡도: 76.6

실험 및 물리화학적 성질

DrugsPharmaceuticals -> Listed in ZINC15

SpringerMaterials PropertiesExcess enthalpy

Density1.019 @25 °C

Boiling Point222.5 °C @760 [mm Hg]

Melting Point-30.8 °C

Physical DescriptionLiquid

물리화학적 성질

녹는점: -31 °C · -31 °C
끓는 점: 222 °C · 222 °C(lit.)
밀도: 1.019 g/mL · 1.019 g/mL at 25 °C(lit.)
증기압: 0.1 mm · 0.1 mm Hg ( 25 °C)
굴절률: 20 · n20/D 1.484(lit.)
인화점: 197 °F · 197 °F
저장 조건: 30 °C · Store below +30°C.
물리적 상태: 액체
산도 계수 (pKa): -0.44 · -0.44±0.20(Predicted)
Specific Gravity: 1.02 · 1.02
색상: 무색투명~미황색
수용성: 자유롭게 용해되는
BRN: 107697 · 107697
Dielectric constant: 26.15 · 26.149999999999999
InChI: 1S/C6H11NO/c8-6-7-4-2-1-3-5-7/h6H,1-5H2
InChIKey: FEWLNYSYJNLUOO-UHFFFAOYSA-N
SMILES: [H]C(=O)N1CCCCC1
NIST: 1 · 1-Piperidinecarboxaldehyde(2591-86-8)
EPA: N-Formylpiperidine (2591-86-8)

화학적 성질

CLEAR COLOURLESS TO SLIGHTLY YELLOW LIQUID

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 58 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Status: Active Update: 16-11-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/18233

1-Formylpiperidine: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 및 보호

Protective Action Criteria (PAC) · 3건

2.7 [mg/m3]

29 [mg/m3]

180 [mg/m3]

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: TN0380000
ridadr: UN 2810 6.1/PG 3
HS 번호: 29333999
risk_code: 21/22-36/37/38
hazard_code: Xn,Xi
safety_code: 26-36/37-36
포장분류: III
위험 등급: 6.1(b)
Hazard Classifications: Acute Tox. 3 DermalAcute Tox. 4 OralEye Irrit. 2
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

약리 정보

Cellular LocationsCytoplasm

용도 및 제조

General Manufacturing Information1-Piperidinecarboxaldehyde: ACTIVE

응용 분야

개요This simple piperidine base has recently been discovered in the oxygenated fraction from Piper nigrum. The structure has been elucidated from chemical and spectroscopic data.

용도Solvent for polar and nonpolar compounds, as well as many high polymers; gas absorption; plastics modifiers.

상·하류 제품 정보

상류 원료

하류 제품

tert-Butyl 4-formylpyridin-3-ylcarbamate 5-Bromo-2-fluoropyridine-3-carbaldehyde 1,3,5-트리스(p-포르밀페닐)벤젠 3-Chloro-4-Cyanobenzaldehyde 1-트리틸이미다졸-4-카르복스알데히드 4-이소부틸벤즈알데히드 6-Hydroxy-2-naphthaldehyde 5-Formyl-2,4-dimethoxypyrimidine

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]

爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

연결된 노트

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포밀피페리딘

기본 정보

개요