2,4-피리딘디카보니트릴

2,4-Pyridinedicarbonitrile

HCID 120144CAS 29181-50-8

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: N#Cc1ccnc(C#N)c1
InChIKey: HLAGQMFURMNTLW-UHFFFAOYSA-N
분자식: C7H3N3
평균 분자량: 129.12 g/mol
단동위원소 질량: 129.03269711

이름 및 식별자

우선 이름: 2,4-Pyridinedicarbonitrile
IUPAC: pyridine-2,4-dicarbonitrile
현지명: 2,4-피리딘디카보니트릴
영어명: Pyridine-2,4-dicarbonitrile
분자식: C7H3N3
분자량: 129.12

이름 및 동의어

Pyridine-2,4-dicarbonitrile2,4-Pyridinedicarbonitrile2,4-DicyanopyridineHJ2X384UBJEINECS 249-492-0UNII-HJ2X384UBJDTXSID8067448RefChem:82644DTXCID5037949HLAGQMFURMNTLW-UHFFFAOYSA-N29181-50-8MFCD00014627

이름 더 보기

2,4-피리딘디카보니트릴Pyridin-2,4-dicarbonitril2,4-Pyridinedicarbonitrile 97%2,4-Pyridinedicarbonitrile ,97%5-(methylsulfonylmethyl)-2-oxolanone2,4-Pyridinedicarbonitrile(6CI,7CI,8CI,9CI)PYRIDINE-2,4-DICARBONITRILE ISO 9001：2015 REACH

Topiroxostat Impurity 27SCHEMBL995799SCHEMBL7170537SCHEMBL295981482,4-Pyridinedicarbonitrile, 97%SBB055735AKOS015892293AS-58697

데이터베이스 식별자

CAS: 29181-50-8
PubChem CID: 120144
DTXSID: DTXSID8067448
UNII: HJ2X384UBJ
EC Number: 249-492-0
Nikkaji: J250.789G

물성

구조 계산 물성

XLogP: 0.6
극성 표면적: 60.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 0
무거운 원자 수: 10
형식 전하: 0
복잡도: 203

물리화학적 성질

녹는점: 89 · 89-93 °C (lit.)
끓는 점: 261.8 · 261.8±20.0 °C(Predicted)
밀도: 1.25 · 1.25±0.1 g/cm3(Predicted)
저장 조건: Inert atmosphere,Room Temperature
산도 계수 (pKa): -3.67 · -3.67±0.10(Predicted)
물리적 상태: solid
BRN: 115936 · 115936
InChI: InChI=1S/C7H3N3/c8-4-6-1-2-10-7(3-6)5-9/h1-3H
InChIKey: HLAGQMFURMNTLW-UHFFFAOYSA-N
SMILES: C1(C#N)=NC=CC(C#N)=C1
NIST: 2 · 2,4-Dicyanopyridine(29181-50-8)
EPA: 2 · 2,4-Pyridinedicarbonitrile (29181-50-8)

화학적 성질

Gray solid

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (90.7%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (90.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 3 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

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Skin Sens. 1 (90.7%)；Eye Dam. 1 (90.7%)；STOT SE 3 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
ridadr: 3276
HS 번호: 29333990
risk_code: 22-37/38-41-43
hazard_code: Xn
safety_code: 26-36
포장분류: III
위험 등급: 6.1
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing Information2,4-Pyridinedicarbonitrile: INACTIVE

상·하류 제품 정보

상류 원료

4-시아노피린딘 과산화 수소 아세트산(빙초산)사이안화 칼륨 디메틸설페이트

공급사50 곳

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

济南百隆化学有限公司[email protected] · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

上海腾准生物科技有限公司19821570922 · [email protected]

연결된 노트

불러오는 중…