3H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-4-carboxylic acid dihydrochloride

HCID 67945944
ノート反応
部分構造検索類似構造を探す

基本情報

CAS
126167-33-7
標準SMILES
Cl.Cl.O=C(O)C1NCCc2[nH]cnc21
InChIKey
KDYFDWRPJISROS-UHFFFAOYSA-N
分子式
C7H11Cl2N3O2
平均分子量
240.08 g/mol
単同位体質量
239.022832

名称と識別子

優先名称
3H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-4-carboxylic acid dihydrochloride
IUPAC
4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxylic acid;dihydrochloride

名称と別名

126167-33-73H,4H,5H,6H,7H-IMIDAZO[4,5-C]PYRIDINE-4-CARBOXYLIC ACID DIHYDROCHLORIDE3H,4H,5H,6H,7H-imidazo(4,5-c)pyridine-4-carboxylic acid dihydrochlorideRefChem:505568974-906-84,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-4-carboxylic acid dihydrochlorideMFCD277565764,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-4-carboxylic acid;dihydrochlorideSCHEMBL9866849KDYFDWRPJISROS-UHFFFAOYSA-NAT27587EN300-7378426
名称をさらに表示
Z50106754074,5,6,7-tetrahydroimidazo[4,5-c]pyridine-4-carboxylic acid dihydrochloride4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE-4-CARBOXYLIC ACID 2HCL4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-4-carboxylicaciddihydrochloride

データベース識別子

CAS
126167-33-7
PubChem CID
67945944
EC Number
974-906-8

物性

構造計算による物性

極性表面積
78 Ų
水素結合供与体数
5
水素結合受容体数
4
回転可能結合数
1
重原子数
14

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (100%): 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)

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

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)

関連反応

2 件
反応記録を作成

化合物ノート

読み込み中…