2-아미노-1-메틸벤즈이미다졸

2-Amino-1-methylbenzimidazole

HCID 74187CAS 1622-57-7
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Cn1c(N)nc2ccccc21
InChIKey
XDFZKQJLNGNJAN-UHFFFAOYSA-N
분자식
C8H9N3
평균 분자량
147.18 g/mol
단동위원소 질량
147.07964729

개요

2-Amino-1-methylbenzimidazole is a member of benzimidazoles.

이름 및 식별자

우선 이름
2-Amino-1-methylbenzimidazole
IUPAC
1-methylbenzimidazol-2-amine
현지명
2-아미노-1-메틸벤즈이미다졸
영어명
2-Amino-1-methylbenzimidazole
분자식
C8H9N3
분자량
147.18

이름 및 동의어

2-Amino-1-methylbenzimidazoleAMBI cpdRefChem:4380621622-57-71-methyl-1H-benzo[d]imidazol-2-amine1-methylbenzimidazol-2-amine1-Methyl-1H-benzimidazol-2-amine1H-Benzimidazol-2-amine, 1-methyl-MFCD001428551-METHYL-2-AMINOBENZIMIDAZOLE1-methyl-1H-1,3-benzodiazol-2-amine2-amino-1-methyl-1h-benzimidazole
이름 더 보기
2-아미노-1-메틸벤즈이미다졸AKOS B000495TIMTEC-BB SBB004092RARECHEM AQ NN 0081ART-CHEM-BB B0004951-methyl-2-benzimidazolamine1-methyl-1h-benzimidazol-2-amin
1-Methyl-1H-benzoimidazol-2-ylamineSCHEMBL1497071-Methyl-1H-benzimidazol-2-ylamineEN300-996291-METHYL-1H-1,3-BENZIMIDAZOL-2-AMINE1-methylbenzimidazole-2-ylamineCCRIS 4355BRN 0608298

데이터베이스 식별자

CAS
1622-57-7
PubChem CID
74187
DTXSID
DTXSID10167330
ChEMBL
CHEMBL1232570
ChEBI
CHEBI:194592
EC Number
627-875-7
Nikkaji
J475.201E

물성

구조 계산 물성

XLogP
0.9
극성 표면적
43.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
11

실험 및 물리화학적 성질

LogP0.95

물리화학적 성질

녹는점
203 · 203-206 °C
끓는 점
257.29 °C · 257.29°C (rough estimate)
밀도
1.1669 · 1.1669 (rough estimate)
굴절률
1.54 · 1.5400 (estimate)
저장 조건
2 · 2-8°C(protect from light)
산도 계수 (pKa)
6.96 · 6.96±0.10(Predicted)

화학적 성질

white to beige fine crystalline powder

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 42 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

안전 데이터

wgk
3
rtecs
DD5423660
HS 번호
29339980
risk_code
36/37/38
hazard_code
Xi
safety_code
26-37/39

화학 및 산업

응용 분야 · 2건

용도2-Amino-1-methylbenzimidazole may be used for the preparation of 2- or 3-carboxy-4H-pyrimido[2,1-b]-benzazol-4-ones and novel functionalized spiropyran′s derivatives of 2H-1,3-benzoxazinone series.

일반 설명The carbonyl-scavenging ability of 2-amino-1-methylbenzimidazole has been investigated. Mechanism of Menshutkin reaction between 2-amino-1-methylbenzimidazole and iodomethane has been studied in gas phase and in liquid acetonitrile. It is reported to form adducts with natural allyl, phenethyl, and benzyl isothiocyanates.

상·하류 제품 정보

공급사50 곳

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
宁波振岳医药科技有限公司19817745290 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
河北贞田食品添加剂有限公司0319-5925599 13373390591
南京翔睿科技有限公司021-021-00000000 15715199582

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