4-아미노-N,N-디에틸아미노-m-톨루이딘하이드로클로라이드

2-Amino-5-(diethylamino)toluene

HCID 67364CAS 148-71-0

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCN(CC)c1ccc(N)c(C)c1
InChIKey: XBTWVJKPQPQTDW-UHFFFAOYSA-N
분자식: C11H18N2
평균 분자량: 178.27 g/mol
단동위원소 질량: 178.14699858

개요

RN given refers to parent cpd; structure

이름 및 식별자

우선 이름: 2-Amino-5-(diethylamino)toluene
IUPAC: 4-N,4-N-diethyl-2-methylbenzene-1,4-diamine
현지명: 4-아미노-N,N-디에틸아미노-m-톨루이딘하이드로클로라이드
영어명: 4-diethylamino-o-toluidine
분자식: C11H18N2
분자량: 178.27

이름 및 동의어

148-71-0A640ZQ81DV3-Methyl-N,N-diethyl-p-phenylenediamine2-AMINO-5-(DIETHYLAMINO)TOLUENECD-2 color developerRefChem:515781N(4),N(4)-diethyl-2-methyl-1,4-benzenediamine1,4-Benzenediamine, N4,N4-diethyl-2-methyl-N1,N1-Diethyl-3-methylbenzene-1,4-diamine4-Diethylamino-o-toluidine4-(Diethylamino)-2-methylanilineN-4,N-4-Diethyl-2-methyl-1,4-benzenediamine

이름 더 보기

4-아미노-N,N-디에틸아미노-m-톨루이딘하이드로클로라이드4-다이에틸아미노-o-톨루딘4-다이에틸아미노-o-톨루딘및그염류4-다이에틸아미노-o-톨루이딘4-디에틸아미노-o-톨루이딘4-(Diethylamino)-2-methyl-1-benzenamineN',N'-Diethyl-2-methyl-1,4-benzenediamine4-Amino-N,N-diethyl-m-toluidine hydrochloride,98%

N4,N4-diethyl-2-methyl-1,4-Benzenediamine4-N,4-N-diethyl-2-methylbenzene-1,4-diamineCHEMBL20943073-methyl-4-amino-n,n-diethylanilineMFCD001375764-Amino-3-methyl-N,N-diethylanilineToluene-2,5-diamine, N5,N5-diethyl-N4,N4-Diethyl-2-methyl-p-phenylenediamine

데이터베이스 식별자

CAS: 148-71-0
PubChem CID: 67364
DTXSID: DTXSID7043879
ChEMBL: CHEMBL2094307
UNII: A640ZQ81DV
EC Number: 205-722-1
Nikkaji: J37.717A

물성

구조 계산 물성

XLogP: 2.1
극성 표면적: 29.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 13
형식 전하: 0
복잡도: 143

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Amines, Aromatic

Physical DescriptionWhite odorless crystalline solid; [Kodak MSDS]

물리화학적 성질

끓는 점: 300.3 · 300.3±22.0 °C(Predicted)
밀도: 0.995 · 0.995±0.06 g/cm3(Predicted)
산도 계수 (pKa): 8.36 · 8.36±0.42(Predicted)
EPA: 1 · 1,4-Benzenediamine, N4,N4-diethyl-2-methyl- (148-71-0)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301+H311+H331 (100%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P261, P262, P264, P270, P271, P272, P273, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P333+P317, P361+P364, 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.

유해성 정보

Hazards Summary · 1건

Can cause skin sensitization; [Marks] May form explosive dust-air mixtures; An eye irritant; Prolonged or repeated skin exposure may cause drying, cracking, or irritation; May cause skin sensitization (positive results in human test); May cause liver injury, based on animal studies (targets liver in repeated-dose oral studies of rats); Harmful by ingestion and inhalation; [Kodak MSDS]

Hazard Classes and CategoriesAcute Tox. 3 (100%)

독성 정보

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.