4-Methoxybenzene-1,2-diamine dihydrochloride
기본 정보
- CAS
59548-39-9- 표준 SMILES
COc1ccc(N)c(N)c1.Cl.Cl- InChIKey
SXCHMHOBHJOXGC-UHFFFAOYSA-N- 분자식
- C7H12Cl2N2O
- 평균 분자량
- 211.09 g/mol
- 단동위원소 질량
- 210.03266836
이름 및 식별자
- 우선 이름
- 4-Methoxybenzene-1,2-diamine dihydrochloride
- IUPAC
- 4-methoxybenzene-1,2-diamine;dihydrochloride
- 영어명
- 4-Methoxy-o-phenylenediamine dihydrochloride
- 분자식
- C7H12Cl2N2O
- 분자량
- 211.09
이름 및 동의어
59548-39-94-Methoxybenzene-1,2-diamine dihydrochlorideEINECS 261-801-01,2-Benzenediamine, 4-methoxy-, dihydrochlorideDTXSID80208229NSC 62971RefChem:99622DTXCID50130720261-801-04-Methoxy-o-phenylenediamine dihydrochloride3,4-Diaminoanisole dihydrochlorideMFCD00052003
이름 더 보기
3,4-DIAMINANISOLEHCL4-Methoxy-2-amino-aniline HCl3,4-DIAMINANISOLE HYDROCHORIDE4-Methoxy-o-phenylenediamine2HClOmeprazole Impurity 22(Dihydrochloride)4-Methoxy-1,2-benzenediamine hydrochloride3,4-DiaMinoanisole dihydrochloride, 98% 1GR
4-methoxybenzene-1,2-diamine;dihydrochlorideAKOS0159196464-Methoxy-1,2-benzenediamine dihydrochloride4-Methoxy-1,2-diaminobenzene dihydrochloride4-methoxy-1,2-phenylenediamine dihydrochloride4-methoxy-l,2-phenylene diamine dihydrochloride[2-amino-4-(methyloxy)phenyl]amine dihydrochloride4-methoxy-o-phenylenediamine bis-hydrochloride salt
데이터베이스 식별자
- CAS
59548-39-9- PubChem CID
- 3085161
- DTXSID
DTXSID80208229- UNII
- 37S4GDY7FJ
- EC Number
- 261-801-0
물성
구조 계산 물성
- 극성 표면적
- 61.3 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 108
물리화학적 성질
- 녹는점
- 206 · 206-209 °C (dec.)(lit.)
- 저장 조건
- 2 · 2-8°C
- 색상
- Pink
- 수용성
- 물에 용해됩니다.
- BRN
- 3699636 · 3699636
- InChI
- 1S/C7H10N2O.2ClH/c1-10-5-2-3-6(8)7(9)4-5;;/h2-4H,8-9H2,1H3;2*1H
- InChIKey
- SXCHMHOBHJOXGC-UHFFFAOYSA-N
- SMILES
- Cl.Cl.COc1ccc(N)c(N)c1
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (13.3%): Harmful if swallowed [Warning Acute toxicity, oral]
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 45 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (13.3%)
안전 데이터
- wgk
- 3
- ridadr
- 2811
- HS 번호
- 29222900
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36
- 포장분류
- III
- 위험 등급
- 6.1(b)
- F 고인화성물질
- 3-10
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
용도4-Methoxy-o-phenylenediamine is widely used as an intermediate in organic synthesis and pharmaceuticals. It is an important precursor for the synthesis of other heterocyclic compounds. It is used in the determination of glyoxal, methylglyoxal, and diacetyl in urine using 4-methoxy-o-phenylenediamine as derivatizing reagent by High-performance liquid chromatography (HPLC).
관련 반응
22건
화합물 노트
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