4-METHOXYBENZAMIDINE

4-Methoxybenzenecarboximidamide

HCID 229074CAS 22265-37-8

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基本信息

标准SMILES: COc1ccc(C(=N)N)cc1
InChIKey: CSISQILZUHMAJB-UHFFFAOYSA-N
分子式: C8H10N2O
平均分子量: 150.18 g/mol
单同位素质量: 150.07931294

名称与标识

首选名称: 4-Methoxybenzenecarboximidamide
IUPAC: 4-methoxybenzenecarboximidamide
中文名: 4-METHOXYBENZAMIDINE
英文名: 4-Methoxybenzamidine for fluorescence
分子式: C8H10N2O
分子量: 150.18

名称与别名

22265-37-84-methoxybenzenecarboximidamideDTXSID20281672RefChem:293981DTXCID202328264-Methoxybenzimidamide4-Methoxy-benzamidine4-Methoxybenzamidine4-methoxybenzene-1-carboximidamideMFCD00029547CHEMBL31388444-methoxybenzenecarboxamidine

展开更多名称

Benzenecarboximidamide, 4-methoxy-4-Methoxybenzamidine for fluorescence4-METHOXYBENZAMIDINE FOR FLUORESCENCE 97+%

4-Methoxyl-benzamidine4-(Methyloxy)benzenecarboximidamideP-AnisamidineSCHEMBL428892SCHEMBL7114596SCHEMBL23235849SCHEMBL28022989PDK0249

数据库标识

CAS: 22265-37-8
PubChem CID: 229074
DTXSID: DTXSID20281672
ChEMBL: CHEMBL3138844
EC Number: 622-603-3
Nikkaji: J900.530G

性质

结构计算性质

XLogP: 0.9
极性表面积: 59.1 Å²
氢键供体: 2
氢键受体: 2
可旋转键: 2
重原子: 11
形式电荷: 0
复杂度: 139

物理化学性质

熔点: 120 · 120-124 °C
储存条件: Keep in dark place,Inert atmosphere,Room temperature
BRN: 637173 · 637173
InChI: 1S/C8H10N2O/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H3,9,10)
InChIKey: CSISQILZUHMAJB-UHFFFAOYSA-N
SMILES: COc1ccc(cc1)C(N)=N

安全与法规

GHS分类

GHS Classification · 4 条

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.