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化工社化工社 化学情報印刷レポート · 研究参考用
HCID 2776197作成日：2026年10月23日

3-フリルメチルアミン

3-フリルメチルアミン · furan-3-ylMethanaMine · 3-(AMINOMETHYL)FURAN · 3-Furfurylamine · 3-furanmethylamine · 3-Furanmethanamine · 3-Furylmethylamine · RARECHEM AL BW 1182

https://huagongshe.com/ja/chemical/2776197

3-フリルメチルアミン の分子構造式

識別子と物理属性

CAS No.4543-47-9
分子式C5H7NO
平均分子量97.12 g/mol
単同位体質量97.05276385 g/mol
SMILESNCc1ccoc1
InChIKeyXNABHFLZYMCJHE-UHFFFAOYSA-N
PubChem CID2776197
EC No.800-812-2
DTXSIDDTXSID20379881
現地名3-フリルメチルアミン

化学・物理的性質

XLogP0
極性表面積39.2
水素結合供与体数1
水素結合受容体数2
回転可能結合数1
重原子数7
形式電荷0
複雑度56
沸点52-54°C 15mm
密度1.053±0.06 g/cm3(Predicted)
貯蔵条件under inert gas (nitrogen or Argon) at 2-8°C
溶解度クロロホルム（微量）、DMSO（微量）、メタノール（微量）
pKa（酸解離定数）9.60±0.40(Predicted)
外観・状態油
色黄色
InChIInChI=1S/C5H7NO/c6-3-5-1-2-7-4-5/h1-2,4H,3,6H2
InChIKeyXNABHFLZYMCJHE-UHFFFAOYSA-N
SMILESO1C=CC(CN)=C1

安全性と法規制

GHS 分類DangerH301 (93%): Toxic if swallowed [Danger Acute toxicity, oral]H319 (90.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 43 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard Classes and CategoriesAcute Tox. 3 (93%)Eye Irrit. 2 (90.7%)
輸送番号（UN）2733
税関コード2932190090
危険文句（R）10-20/21/22-34-36-25
危険表示C,Xi,T
hazard_noteIrritant
安全措置（S）26-36/37/39-45