4,5,6,7-테트라히드로-1H-벤조이미다졸-5-카르복실산

4,5,6,7-Tetrahydro-1H-benzimidazole-6-carboxylic acid

HCID 11030183

노트 반응

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기본 정보

CAS: 26751-24-6
표준 SMILES: O=C(O)C1CCc2nc[nH]c2C1
InChIKey: LQXRWFGXMQZLIV-UHFFFAOYSA-N
분자식: C8H10N2O2
평균 분자량: 166.18 g/mol
단동위원소 질량: 166.07422756

이름 및 식별자

우선 이름: 4,5,6,7-Tetrahydro-1H-benzimidazole-6-carboxylic acid
IUPAC: 4,5,6,7-Tetrahydro-1H-benzimidazole-6-carboxylic acid
현지명: 4,5,6,7-테트라히드로-1H-벤조이미다졸-5-카르복실산
영어명: 4,5,6,7-Tetrahydro-1H-benzoimidazole-5-carboxylic acid
분자식: C8H10N2O2
분자량: 166.18

이름 및 동의어

4,5,6,7-테트라히드로-1H-벤조이미다졸-5-카르복실산4,5,6,7-Tetrahydro-1H-benzo[d]iMidazole-5-carboxylic acid4,5,6,7-Tetrahydro-1H-benzo[d]imidazole-6-carboxylic acidRamosetron Impurity 15Ramosetron Impurity 114,5,6,7-Tetrahydro-1H-benziMidazole-5-carboxylic4,5,6,7-Tetrahydro-1H-benzoimidazole-5-carboxylic4,5,6,7-Tetrahydro-1H-benzimidazole-5-carboxylic acid4,5,6,7-Tetrahydro-1H-benzimidazole-6-carboxylic acid4,5,6,7-TETRAHYDRO-1H-BENZOIMIDAZOLE-5-CARBOXYLIC ACID1H-Benzimidazole-6-carboxylic acid, 4,5,6,7-tetrahydro-

데이터베이스 식별자

CAS: 26751-24-6
PubChem CID: 11030183
DTXSID: DTXSID40949560
ChEMBL: CHEMBL1789798
Nikkaji: J1.624.386H

물성

물리화학적 성질

끓는 점: 498.3 · 498.3±45.0 °C(Predicted)
밀도: 1.384 · 1.384±0.06 g/cm3(Predicted)
저장 조건: Sealed in dry,Room Temperature
산도 계수 (pKa): 3.94 · 3.94±0.20(Predicted)
InChI: InChI=1S/C8H10N2O2/c11-8(12)5-1-2-6-7(3-5)10-4-9-6/h4-5H,1-3H2,(H,9,10)(H,11,12)
InChIKey: LQXRWFGXMQZLIV-UHFFFAOYSA-N
SMILES: C1NC2CC(C(O)=O)CCC=2N=1

안전 및 규제

안전 데이터

위험 등급: IRRITANT

화학 및 산업

응용 분야

용도4,5,6,7-Tetrahydro-1H-benzimidazole-5-carboxylic Acid is a conformationally restricted inhibitor of active thrombin activatable fibrinolysis inhibitor (TAFI) . Activated TAFI protects fibrin clots against lysis.