2,5-디메톡시아닐린

2,5-Dimethoxyaniline

HCID 7613CAS 102-56-7
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COc1ccc(OC)c(N)c1
InChIKey
NAZDVUBIEPVUKE-UHFFFAOYSA-N
분자식
C8H11NO2
평균 분자량
153.18 g/mol
단동위원소 질량
153.07897859

이름 및 식별자

우선 이름
2,5-Dimethoxyaniline
IUPAC
2,5-dimethoxyaniline
현지명
2,5-디메톡시아닐린
영어명
2,5-Dimethoxyaniline
분자식
C8H11NO2
분자량
153.18

이름 및 동의어

2,5-DIMETHOXYANILINE102-56-7Benzenamine, 2,5-dimethoxy-Aminohydroquinone dimethyl ether1-Amino-2,5-dimethoxybenzeneAniline, 2,5-dimethoxy-2,5-DimethoxybenzenamineMFCD00008368C.I. 35811BRN 0776823V3Z5U3FL10WLN: 1OR BZ DO1
이름 더 보기
2,5-디메톡시아닐린C2H11NO2c.i.35811AURORA KA-673AKOS BBS-00003545TIMTEC-BB SBB0075812,5-dimethoxy-anilinDIMETHOXYANILINE(2,5-)2,5-DIMETHOXY-BENZAMINE
SCHEMBL92071MLS000053359BDBM55250NSC-4138PS-3249SMR0000632862,5-dimethoxyphenylamineD1893

데이터베이스 식별자

CAS
102-56-7
PubChem CID
7613
DTXSID
DTXSID4059257
ChEMBL
CHEMBL1616799
UNII
V3Z5U3FL10
EC Number
203-040-9
Nikkaji
J55.364F

물성

구조 계산 물성

XLogP
1.2
극성 표면적
44.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
2
무거운 원자 수
11

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Amines, Aromatic
SpringerMaterials PropertiesDensity
LogP1.2
Vapor Pressure0.00828 [mmHg]
Physical DescriptionBrown powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
78 · 78-80 °C (lit.)
끓는 점
140 °C · 140 °C (7 mmHg)
밀도
1.1577 · 1.1577 (rough estimate)
증기압
0.19 Pa · 0.19Pa at 20℃
굴절률
1.477 · 1.4770 (estimate)
인화점
130 °C · 130 °C

화학적 성질

grey to dark brown crystalline powder or lumps

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (88.5%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P264, P270, P301+P316, P301+P317, P319, P321, P330, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 52 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Benzenamine, 2,5-dimethoxy-

Status: Active Update: 27-06-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/5256

Benzenamine, 2,5-dimethoxy-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1건

Causes somnolence, methemoglobinemia, liver and kidney changes, and general anesthesia in acute oral studies of mice; [RTECS] May cause irritation; May induce methemoglobinemia; Toxic by ingestion, inhalation, and skin absorption; Prolonged or repeated exposure may cause organ injury; [Alfa Aesar MSDS]

Hazard Classes and CategoriesAcute Tox. 3 (88.5%)

독성 정보

Adverse EffectsNeurotoxin - Other CNS neurotoxin

안전 데이터

wgk
1
tsca
TSCA listed
rtecs
BX4375000
ridadr
UN 2811 6.1/PG 3
독성
bird - wild,LD50,oral,100mg/kg (100mg/kg),Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972.
HS 번호
29214200

화학 및 산업

용도 및 제조

UsesUsed as an intermediate; [ExPub: ECHA REACH Registrations]
General Manufacturing InformationBenzenamine, 2,5-dimethoxy-: ACTIVE

응용 분야

용도2,5-Dimethoxyaniline is used as a laccase inducer which immobilizes the enzyme laccase from Trumetes versicolor.

상·하류 제품 정보

하류 제품

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

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