3-디메틸아미노페놀

3-(Dimethylamino)phenol

HCID 7421CAS 99-07-0

기본 정보

표준 SMILES
CN(C)c1cccc(O)c1
InChIKey
MESJRHHDBDCQTH-UHFFFAOYSA-N
분자식
C8H11NO
평균 분자량
137.18 g/mol
단동위원소 질량
137.08406397

개요

3-dimethylaminophenol appears as needles (from ligroin) or a dark gray solid. (NTP, 1992)

이름 및 식별자

우선 이름
3-(Dimethylamino)phenol
IUPAC
3-(dimethylamino)phenol
현지명
3-디메틸아미노페놀
영어명
3-Dimethylaminophenol
분자식
C8H11NO
분자량
137.18

이름 및 동의어

3-DIMETHYLAMINOPHENOL3-(Dimethylamino)phenol99-07-0Phenol, 3-(dimethylamino)-m-(Dimethylamino)phenolPhenol, m-(dimethylamino)-(3-Hydroxyphenyl)dimethylamineN,N-Dimethyl-m-aminophenol3-Hydroxy-N,N-dimethylaniline3-N,N-DimethylaminophenolDTXSID0025101X6Q73Z0ZIJ
이름 더 보기
3-디메틸아미노페놀3-DMAPDIMETHYLAMINOPHENOLNeostigmine impurity BNSC 62017JACS-99-07-03-DIMETHYLAMINPHENOL
DTXCID105101M-(N,N-DIMETHYLAMINO)PHENOLNSC-62017RefChem:495062202-727-0N,N-Dimethyl-3-aminophenol3-(Dimethylamlno)phenolm-Dimethylaminophenol

데이터베이스 식별자

CAS
99-07-0
PubChem CID
7421
DTXSID
DTXSID0025101
ChEMBL
CHEMBL225257
UNII
X6Q73Z0ZIJ
EC Number
202-727-0
Nikkaji
J113.882K

물성

구조 계산 물성

XLogP
1.6
극성 표면적
23.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
10

실험 및 물리화학적 성질

LogP1.56
Solubilityless than 0.1 mg/mL at 68 °F (NTP, 1992)
Boiling Point509 to 514 °F at 760 mmHg (NTP, 1992)
Melting Point180 to 183 °F (NTP, 1992)
Physical Description3-dimethylaminophenol appears as needles (from ligroin) or a dark gray solid. (NTP, 1992)

물리화학적 성질

녹는점
82 · 82-84 °C(lit.)
끓는 점
265 · 265-268°C
밀도
1.0976 · 1.0976 (rough estimate)
굴절률
1.5895 · 1.5895 (estimate)
인화점
148 °C · 148 °C
저장 조건
Keep in dark place,Inert atmosphere,Room temperature

화학적 성질

Brown to Purple Solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 152 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationChemical: Phenol, 3-(dimethylamino)-
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include irritation of the skin, eyes and mucous membranes.
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1건

An amine and phenol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides. Phenols do not behave as organic alcohols, as one might guess from the presence of a hydroxyl (-OH) group in their structure. Instead, they react as weak organic acids. Phenols and cresols are much weaker as acids than common carboxylic acids (phenol has pKa = 9.88). These materials are incompatible with strong reducing substances such as hydrides, nitrides, alkali metals, and sulfides. Flammable gas (H2) is often generated, and the heat of the reaction may ignite the gas. Heat is also generated by the acid-base reaction between phenols and bases. Such heating may initiate polymerization of the organic compound. Phenols are sulfonated very readily (for example, by concentrated sulfuric acid at room temperature). The reactions generate heat. Phenols are also nitrated very rapidly, even by dilute nitric acid.

Air and Water ReactionsSensitive to prolonged exposure to air. Insoluble in water.

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
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: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol 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.

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)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
SL1050000
HS 번호
29222900
risk_code
36/37/38-20/21/22
hazard_code
Xi,Xn

화학 및 산업

용도 및 제조

General Manufacturing InformationPhenol, 3-(dimethylamino)-: ACTIVE

응용 분야

용도3-Dimethylaminophenol can be used as neostigmine bromide intermediate and dye intermediate.

일반 설명Needles (from ligroin) or a dark gray solid.

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]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

관련 반응

62건

연결된 노트

불러오는 중…