2,4-Dimethoxyaniline

HCID 17652CAS 2735-04-8

기본 정보

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

개요

2,4-dimethoxyaniline is a black crystalline solid. (NTP, 1992)

이름 및 식별자

우선 이름
2,4-Dimethoxyaniline
IUPAC
2,4-dimethoxyaniline
영어명
2,4-Dimethoxyaniline
분자식
C8H11NO2
분자량
153.18

이름 및 동의어

2,4-DIMETHOXYANILINEBenzenamine, 2,4-dimethoxy-Aniline, 2,4-dimethoxy-2,4-dimethoxyphenylamineDTXSID7043829NSC 620192,4-dimethoxybenzenamineHSDB 4125EINECS 220-355-71-Amino-2,4-dimethoxybenzeneBRN 06387042,4-Domethoxyaniline
이름 더 보기
AKOS BBS-000036274-AMINORESORCINOL4-DiMethoxyaniline2,4-dimethoxy-anilin2,4-Dimethoxyaniline C2,4-DIMETHOXY BENZAMINE2,4-Dimethoxyaniline>2,4-dimethoxybenzenamine
4-Aminoresorcinol dimethyl etherDTXCID5023829I079354GSI2,4-DIMETHOXYANILINE [HSDB]NSC-62019UNII-I079354GSI4-13-00-02529 (Beilstein Handbook Reference)Aniline, 2,4dimethoxy

데이터베이스 식별자

CAS
2735-04-8
PubChem CID
17652
DTXSID
DTXSID7043829
ChEMBL
CHEMBL1622132
UNII
I079354GSI
EC Number
220-355-7
Nikkaji
J55.221F

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
Color/FormPLATES FROM PETROLEUM ETHER
Solubility · 2건

less than 1 mg/mL at 63 °F (NTP, 1992)

SLIGHTLY SOL IN WATER; SOL IN ETHER, ALC, BENZENE, HOT PETROLEUM ETHER

Melting Point · 2건

92.3 °F (NTP, 1992)

33.5 °C

Physical Description · 2건

2,4-dimethoxyaniline is a black crystalline solid. (NTP, 1992)

Black solid; [CAMEO] Black solid; mp = 34-37 deg C; [MSDSonline]

Other Experimental PropertiesUV: 6158 (Sadtler Research Laboratories Spectral Collection) /3,4-Dimethoxyaniline/

물리화학적 성질

녹는점
33 · 33-36 °C (lit.)
끓는 점
75 · 75-80 C
밀도
1.075 g/mL · 1.075 g/mL at 25 °C (lit.)
굴절률
1.464 · 1.4640 (estimate)
인화점
230 °F · >230 °F
저장 조건
Keep in dark place,Inert atmosphere,Room temperature

화학적 성질

black crystals

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, 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 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: Benzenamine, 2,4-dimethoxy-

2,4-Dimethoxyaniline: Does not have an individual approval but may be used under an appropriate group standard

DOT LabelPoison
Fire HazardsExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Health HazardsACUTE/CHRONIC HAZARDS: This compound is a local irritant. (NTP, 1992)
Hazards SummaryEmergency treatment: Methemoglobinemia; No evidence of carcinogenicity in rats or mice; [HSDB] A local irritant; [CAMEO] An irritant; May induce methemoglobinemia; [MSDSonline]
Reactive GroupAmines, Aromatic

안전 및 보호

Fire FightingExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Personal Protective Equipment (PPE) · 1건

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

독성 정보

Adverse EffectsMethemoglobinemia - The presence of increased methemoglobin in the blood; the compound is classified as secondary toxic effect
Ongoing Test Status · 1건

The following link will take the user to the National Toxicology Program (NTP) Test Agent Search Results page, which tabulates all of the "Standard Toxicology & Carcinogenesis Studies", "Developmental Studies", and "Genetic Toxicity Studies" performed with this chemical. Clicking on the "Testing Status" link will take the user to the status (i.e., in review, in progress, in preparation, on test, completed, etc.) and results of all the studies that the NTP has done on this chemical. /2,4-Dimethoxyaniline hydrochloride/ [http://ntp-apps.niehs.nih.gov/ntp_tox/index.cfm?fuseaction=ntpsearch.searchresults&searchterm=54150-69-5]

Non-Human Toxicity Excerpts · 1건

... Under the conditions of this bioassay there was no convincing evidence for the carcinogenicity of 2,4-dimethoxyaniline HCl in Fischer 344 rats or B6C3F1 mice. Levels of Evidence of Carcinogenicity: Male Rats: Negative; Female Rats: Negative; Male Mice: Negative; Female Mice: Negative.

National Toxicology Program Studies · 1건

A bioassay for the possible carcinogenicity of 2,4-dimethoxyaniline HCl was conducted using Fischer 344 rats and B6C3F1 mice. 2,4-Dimethoxyaniline HCl was admin in the feed, at either of two concn, to groups of 50 male and 50 female animals of each species. Twenty animals of each sex and species were placed on test as controls. The high and low dietary concn of 2,4-dimethoxyaniline HCl were, respectively, 3,000 and 1,500 ppm for rats and 5,000 and 2,500 ppm for mice. The cmpd was admin in the diet for 104 wk to rats and 103 wk to mice, followed by a l wk observation period for both species. ... Adequate numbers of animals in all groups survived sufficiently long to be at risk from late-developing tumors. ... Under the conditions of this bioassay there was no convincing evidence for the carcinogenicity of 2,4-dimethoxyaniline HCl in Fischer 344 rats or B6C3F1 mice. Levels of Evidence of Carcinogenicity: Male Rats: Negative; Female Rats: Negative; Male Mice: Negative; Female Mice: Negative.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
BX4200000
ridadr
2811
독성
mouse,LD50,oral,1gm/kg (1000mg/kg),Progress Report for Contract No. NIH-NCI-E-C-72-3252, Submitted to the National Cancer Institute by Litton Bionetics, Inc. Vol. NCI-E-C-72-3252, Pg. 1973,
HS 번호
29214200

화학 및 산업

용도 및 제조

Uses · 2건

Used as an intermediate for C.I. basic yellow 11; Not currently manufactured in the US; [HSDB]

CHEMICAL INTERMEDIATE FOR C.I. BASIC YELLOW 11

U.S. Exports · 2건

(1977) No Data

(1979) No Data

U.S. Imports · 2건

(1977) 3.28X10+7 G (PRINCPL CUSTMS DISTS)

(1979) 1.62X10+7 G (PRINCPL CUSTMS DISTS)

U.S. Production · 2건

(1976) PROBABLY GREATER THAN 2.27X10+6 GRAMS

(1979) NOT PRODUCED COMMERCIALLY IN US

General Manufacturing InformationBenzenamine, 2,4-dimethoxy-: ACTIVE
응용 분야 · 2건

용도Various 2,4-dimethoxyphenylsemicarbazones were synthesized starting from 2,4-dimethoxyaniline via a phenylcarbamate intermediate. The hydrochloride of 2,4-dimethoxyaniline was prepared by intro- ducing hydrogen chloride gas into an etheral solution and washing the precipitate with absolute diethyl ether.

일반 설명Black crystalline solid.

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

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