2-Hydrazinopyrazine

HCID 1487823CAS 54608-52-5

기본 정보

표준 SMILES: NNc1cnccn1
InChIKey: IVRLZJDPKUSDCF-UHFFFAOYSA-N
분자식: C4H6N4
평균 분자량: 110.12 g/mol
단동위원소 질량: 110.05924619

이름 및 식별자

우선 이름: 2-Hydrazinopyrazine
IUPAC: pyrazin-2-ylhydrazine
영어명: 2-Hydrazinopyrazine
분자식: C4H6N4
분자량: 110.12

이름 및 동의어

2-hydrazinopyrazineRefChem:472935689-669-32-hydrazinylpyrazine54608-52-5Pyrazin-2-yl-hydrazinepyrazin-2-ylhydrazineMFCD041145552(1H)-Pyrazinone, hydrazonehydrazino pyrazine2-(Pyrazin-2-yl)hydrazinePyrazin-2-yl hydrazine

이름 더 보기

SELI-007HydrazinopyrazinePyrazinylhydrazine2-Hydrazinylpyrazin3-Hydrazine pyrazine2-hydrazineylpyrazine1-(pyrazin-2-ylydrazine

SCHEMBL108576OSM-S-650DTXSID50363374PB127981-(pyrazin-2-yl)hydrazine2-hydrazinylpypyrazinyl hydrazine3-hydrazinopyrazine

데이터베이스 식별자

CAS: 54608-52-5
PubChem CID: 1487823
DTXSID: DTXSID50363374
EC Number: 689-669-3
Nikkaji: J1.734.112J

물성

구조 계산 물성

XLogP: -0.2
극성 표면적: 63.8 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 8
형식 전하: 0
복잡도: 65.1

물리화학적 성질

녹는점: 109 · 109-113℃
끓는 점: 246.3 · 246.3±23.0 °C(Predicted)
밀도: 1.39 · 1.39±0.1 g/cm3(Predicted)
저장 조건: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
산도 계수 (pKa): 5.1 · 5.10±0.20(Predicted)
물리적 상태: 고체
색상: 노란색
수용성: 물에 약간 용해됩니다.
InChI: InChI=1S/C4H6N4/c5-8-4-3-6-1-2-7-4/h1-3H,5H2,(H,7,8)
InChIKey: IVRLZJDPKUSDCF-UHFFFAOYSA-N
SMILES: C1(NN)=NC=CN=C1

화학적 성질

Pale yellow solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (95.5%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (95.5%)

안전 데이터

HS 번호: 29339900
risk_code: 22-41-36/37/38
hazard_code: Xn
safety_code: 26-39-36/37/39

화학 및 산업

응용 분야

용도Triazolo[4,3-a]pyrazine 7-oxide, 3-β-D-ribofuranosyl-1,2,4-triazolo[4,3-a]pyrazine, monohydrazones of pyridine, pyrazine, phenylglyoxal were synthesised from 2-Hydrazinopyrazine.