2,3-디메틸인돌

2,3-Dimethylindole

HCID 7053
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기본 정보

CAS
91-55-4
표준 SMILES
Cc1[nH]c2ccccc2c1C
InChIKey
PYFVEIDRTLBMHG-UHFFFAOYSA-N
분자식
C10H11N
평균 분자량
145.2 g/mol
단동위원소 질량
145.08914936

이름 및 식별자

우선 이름
2,3-Dimethylindole
IUPAC
2,3-dimethyl-1H-indole
현지명
2,3-디메틸인돌
영어명
2,3-Dimethylindole
분자식
C10H11N
분자량
145.2

이름 및 동의어

2,3-Dimethylindole2,3-Dimethyl-1H-indole91-55-41H-Indole, 2,3-dimethyl-INDOLE, 2,3-DIMETHYL-TFW7O9HWZKDTXSID6059027NSC-24936RefChem:442536DTXCID0048719202-076-2NSC 24936
이름 더 보기
2,3-디메틸인돌2,3-dimethyl-indol2,3-DIMETHYLINDOLINE2.3.3-Trimethyl-6,7-2,3-dimethyl-1h-indol2,3-Dimethylindole,98%
MFCD00005617UNII-TFW7O9HWZK2,3-Dimethylindole, >=97%CHEMBL3252119HMS1648J03STL377851SY048829D1579

데이터베이스 식별자

CAS
91-55-4
PubChem CID
7053
DTXSID
DTXSID6059027
ChEMBL
CHEMBL3252119
UNII
TFW7O9HWZK
EC Number
202-076-2
Nikkaji
J45.614D

물성

구조 계산 물성

XLogP
2.8
극성 표면적
15.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
0
회전 가능 결합 수
0
무거운 원자 수
11

실험 및 물리화학적 성질

Vapor Pressure0.00179 [mmHg]
Physical DescriptionWhite crystalline solid; [Alfa Aesar MSDS]
Kovats Retention Index · 3건

1490.3；1476；1484；1499；1477.2

1507.4；257.32；255.48

2502；2539

물리화학적 성질

녹는점
105 · 105-107 °C (lit.)
끓는 점
285 °C · 285 °C (lit.)
밀도
1.0641 · 1.0641 (estimate)
굴절률
1.603 · 1.6030 (estimate)
인화점
285 °C/750mm · 285°C/750mm
저장 조건
2 · under inert gas (nitrogen or Argon) at 2–8 °C

화학적 성질

White to yellow powder

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information1H-Indole, 2,3-dimethyl-: 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.
Hazards SummaryMay cause irritation; [Alfa Aesar MSDS] See 3-Methylindole.
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (50%)；Eye Irrit. 2A (50%)；Acute Tox. 4 (100%)；STOT SE 3 (50%)

규제 정보

Regulatory Information1H-Indole, 2,3-dimethyl-: 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.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
NL7185000
HS 번호
29339900
safety_code
24/25
스토리지 클래스
11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing Information1H-Indole, 2,3-dimethyl-: ACTIVE
응용 분야 · 1건

용도2,3-Dimethylindole has been used to study the mechanism of oxidation of 2,3-dimethylindole by peroxodisulphate and peroxomonosulphate anions to 2-methylindole-2-carbaldehyde. It has been used to study the behaviour of methylindoles in the agilent multimode ion source by atmospheric pressure chemical ionization mass spectrometry.

상·하류 제품 정보

상류 원료

공급사100 곳

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]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]

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