6-Chloropyrimidine-2,4,5-triamine

HCID 500505CAS 1194-78-1

기본 정보

표준 SMILES: Nc1nc(N)c(N)c(Cl)n1
InChIKey: BMCHNFZLERXZBI-UHFFFAOYSA-N
분자식: C4H6ClN5
평균 분자량: 159.58 g/mol
단동위원소 질량: 159.0311729

이름 및 식별자

우선 이름: 6-Chloropyrimidine-2,4,5-triamine
IUPAC: 6-chloropyrimidine-2,4,5-triamine
영어명: 2,4,5-Triamino-6-chloropyrimidine
분자식: C4H6ClN5
분자량: 159.58

이름 및 동의어

6-chloropyrimidine-2,4,5-triamine1194-78-1DTXSID10333331RefChem:308149DTXCID202844212,4,5-Pyrimidinetriamine, 6-chloro-2,4,5-TRIAMINO-6-CHLOROPYRIMIDINEMFCD111144486-chloro-2,4,5-PyrimidinetriamineSCHEMBL1512060SCHEMBL29419387BMCHNFZLERXZBI-UHFFFAOYSA-N

이름 더 보기

2,4,5-Triamino-6-chloropyrimid2,4,5-Triamio-6-chloropyrimidine2,4,5-Triamino-6-hydroxypyrimidine dihydrochloride

AKOS006305893SB57688DS-11134SY114221DB-061569CS-0106539C71642EN300-1273031

데이터베이스 식별자

CAS: 1194-78-1
PubChem CID: 500505
DTXSID: DTXSID10333331
EC Number: 982-227-3

물성

구조 계산 물성

XLogP: -0.2
극성 표면적: 104 Å²
수소 결합 공여자 수: 3
수소 결합 수용자 수: 5
회전 가능 결합 수: 0
무거운 원자 수: 10
형식 전하: 0
복잡도: 120

물리화학적 성질

저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+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 2 reports by companies from 1 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.