2-아미노-6-메톡시벤조티아졸

2-Amino-6-methoxybenzothiazole

HCID 15630CAS 1747-60-0

기본 정보

표준 SMILES
COc1ccc2nc(N)sc2c1
InChIKey
KZHGPDSVHSDCMX-UHFFFAOYSA-N
분자식
C8H8N2OS
평균 분자량
180.23 g/mol
단동위원소 질량
180.03573388

개요

2-amino-6-methoxybenzothiazole is a fine off-white to light tan powder. (NTP, 1992)

이름 및 식별자

우선 이름
2-Amino-6-methoxybenzothiazole
IUPAC
6-methoxy-1,3-benzothiazol-2-amine
현지명
2-아미노-6-메톡시벤조티아졸
영어명
2-Amino-6-methoxybenzothiazole
분자식
C8H8N2OS
분자량
180.23

이름 및 동의어

2-Amino-6-methoxybenzothiazole1747-60-02-Benzothiazolamine, 6-methoxy-6-Methoxy-2-aminobenzothiazole6-METHOXY-2-BENZOTHIAZOLAMINEBenzothiazole, 2-amino-6-methoxy-DTXSID9024485LAT2842YVXNSC-27516DTXCID604485RefChem:85321217-130-0
이름 더 보기
2-아미노-6-메톡시벤조티아졸AKOS AUF2099AURORA KA-685ASISCHEM B88987AKOS BBS-00005696TIMTEC-BB SBB003746IFLAB-BB F1386-03902-Amino-6-methoxyben6-methoxy-2-benzothiazolamin
6-methoxy-1,3-benzothiazol-2-amine6-methoxybenzo[d]thiazol-2-amine2-Amino-6-methoxy benzothiazole6-Methoxybenzothiazol-2-ylamine6-Methoxy-benzothiazol-2-ylamineMFCD000057872-amino-6-methoxybenzthiazoleCHEMBL97797

데이터베이스 식별자

CAS
1747-60-0
PubChem CID
15630
DTXSID
DTXSID9024485
ChEMBL
CHEMBL97797
UNII
LAT2842YVX
EC Number
217-130-0
Nikkaji
J37.323K

물성

구조 계산 물성

XLogP
2.4
극성 표면적
76.4 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
12

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Thiazoles
SpringerMaterials PropertiesChemical shift
Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Boiling Point464 °F at 760 mmHg (decomposes) (NTP, 1992)
Melting Point329 to 333 °F (NTP, 1992)
Physical Description · 2건

2-amino-6-methoxybenzothiazole is a fine off-white to light tan powder. (NTP, 1992)

Off-white to light tan solid; [CAMEO] Powder; [Alfa Aesar MSDS]

물리화학적 성질

녹는점
165 · 165-167 °C (lit.)
끓는 점
240 °C · 240°C
밀도
1.2425 · 1.2425 (rough estimate)
굴절률
1.569 · 1.5690 (estimate)
저장 조건
Keep in dark place,Inert atmosphere,Room temperature
용해도
very slightly in Methanol

화학적 성질

off-white to tan-coloured powder

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 4.1% (2 of 49) of reports.

Warning

H302 (93.9%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 49 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: 2-Benzothiazolamine, 6-methoxy-

Status: Active Update: 07-03-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/33192

2-Benzothiazolamine, 6-methoxy-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Fire HazardsFlash point data for this chemical are not available; however, it is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound include irritation.
Hazards SummaryIntravenous LD50 (mouse) = 140 mg/kg; [RTECS] May cause irritation; [NTP] An irritant; Risk of irreversible adverse health effects; [Alfa Aesar MSDS] See 2-Aminobenzothiazole.
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile2-AMINO-6-METHOXYBENZOTHIAZOLE may be sensitive to exposure to light. This chemical is incompatible with strong oxidizers. (NTP, 1992)

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. A water spray may also be used. (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
DL2100000
ridadr
2811
독성
mouse,LD50,intravenous,140mg/kg (140mg/kg),Journal of Pharmacology and Experimental Therapeutics. Vol. 105, Pg. 486, 1952.
HS 번호
29342080

화학 및 산업

용도 및 제조

UsesUsed as a dye intermediate; [NTP]
General Manufacturing Information2-Benzothiazolamine, 6-methoxy-: ACTIVE
응용 분야 · 2건

용도2-Amino-6-methoxybenzothiazole was used as building block in the syntheses of novel series of Schiff bases and 4-thiazolidinones. It was used in the synthesis of 2-cyano-6-methoxybenzothiazole, key intermediate for the synthesis of firefly luciferin.

일반 설명Fine off-white to light tan powder.

공급사50 곳

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上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
武汉问津化学科技有限公司13517196568 · [email protected]

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81건

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