2,3-Diamino-6-methoxypyridine

HCID 3023920CAS 28020-38-4

기본 정보

표준 SMILES: COc1ccc(N)c(N)n1
InChIKey: WEPOCTWSRWLQLL-UHFFFAOYSA-N
분자식: C6H9N3O
평균 분자량: 139.16 g/mol
단동위원소 질량: 139.07456192

이름 및 식별자

우선 이름: 2,3-Diamino-6-methoxypyridine
IUPAC: 6-methoxypyridine-2,3-diamine
영어명: 2,3-Diamino-6-methoxypyridine
분자식: C6H9N3O
분자량: 139.16

이름 및 동의어

6-methoxypyridine-2,3-diamine2,3-Diamino-6-methoxypyridine2,3-Pyridinediamine, 6-methoxy-6-METHOXY-2,3-PYRIDINEDIAMINE6-METHOXY-2,3-DIAMINOPYRIDINEPyridine, 2,3-diamino-6-methoxy-UNII-VGV76K138FVGV76K138FDTXSID80388570RefChem:81544DTXCID00208125858-385-3

이름 더 보기

TENA-0022,3-diamino-6-methoxpyridine2,3-DIAMINO-6-METHOXYPYRIDINE HCL2,3-Diamino-6-methoxypyridine Hydrochlor2,3-DIAMINO-6-METHOXYPYRIDINE HYDROCHLORIDE2,3-Diamino-6-methoxypyridine hydrochloride 98%6-methoxypyridine-2,3-diamine2,3-diamino-6-methoxypyridine6-Methoxy-pyridin-2,3-diamine2,3-diamino-6-methoxy-pyridine

28020-38-4MFCD06658229SCHEMBL126903SCHEMBL294248446-methoxy-pyridine-2,3-diamineWEPOCTWSRWLQLL-UHFFFAOYSA-N6-(Methyloxy)-2,3-pyridinediamineAKOS006282278

데이터베이스 식별자

CAS: 28020-38-4
PubChem CID: 3023920
DTXSID: DTXSID80388570
UNII: VGV76K138F
EC Number: 858-385-3
Nikkaji: J313.756B

물성

구조 계산 물성

XLogP: 0.1
극성 표면적: 74.2 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 109

물리화학적 성질

녹는점: 168 · 168-170°C
끓는 점: 321.7 · 321.7±37.0 °C(Predicted)
밀도: 1.251 · 1.251±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C(protect from light)
산도 계수 (pKa): 4.55 · 4.55±0.50(Predicted)

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.