2-amino-1-((4-fluorophenyl)methyl)-1H-benzimidazole

HCID 3019305

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 83783-69-1
표준 SMILES: Nc1nc2ccccc2n1Cc1ccc(F)cc1
InChIKey: XEARVXVLEKCISU-UHFFFAOYSA-N
분자식: C14H12FN3
평균 분자량: 241.26 g/mol
단동위원소 질량: 241.10152556

이름 및 식별자

우선 이름: 2-amino-1-((4-fluorophenyl)methyl)-1H-benzimidazole
IUPAC: 1-[(4-fluorophenyl)methyl]benzimidazol-2-amine
영어명: 2-Amino-1-((4-fluorophenyl)methyl)benzi&
분자식: C14H12FN3
분자량: 241.26

이름 및 동의어

EINECS 280-803-22-Amino-1-[(4-fluorophenyl)methyl]-1H-benzimidazole1-[(4-fluorophenyl)methyl]-1H-benzimidazol-2-amine2-Amino-1-((4-fluorophenyl)methyl)-1H-benzimidazole1-((4-Fluorophenyl)methyl)-1H-benzimidazol-2-amineRefChem:462950280-803-283783-69-11-(4-Fluorobenzyl)-1H-benzo[d]imidazol-2-amine1-(4-Fluorophenylmethyl)-2-aminobenzimidazole1-(4-fluorobenzyl)-1H-benzimidazol-2-amine1-[(4-fluorophenyl)methyl]-1H-1,3-benzodiazol-2-amine

이름 더 보기

4-FLUORBENZYL-1H-BENZIMIDAZOOL-2-YLAMINE2-Amino-1-((4-fluorophenyl)methyl)benzi&1-[(4-fluorophenyl)methyl]-2-benzimidazolamine1H-Benzimidazol-2-amine, 1-[(4-fluorophenyl)methyl]-1-(4-fluorobenzyl)-1H-benzimidazol-2-amine(SALTDATA: FREE)

1-[(4-fluorophenyl)methyl]benzimidazol-2-amineDTXSID5057838MFCD00667027SCHEMBL9630558CHEMBL3183133DTXCID6031627Tox21_113754STK260261

데이터베이스 식별자

CAS: 83783-69-1
PubChem CID: 3019305
DTXSID: DTXSID5057838
ChEMBL: CHEMBL3183133
EC Number: 280-803-2
Nikkaji: J296.221G

물성

구조 계산 물성

XLogP: 2.6
극성 표면적: 43.8 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 18
형식 전하: 0
복잡도: 278

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.