5-苯基-2-糠醛

5-Phenyl-2-furaldehyde

HCID 2769420CAS 13803-39-9

子结构检索查找相似结构

基本信息

标准SMILES: O=Cc1ccc(-c2ccccc2)o1
InChIKey: BMJHNNPEPBZULA-UHFFFAOYSA-N
分子式: C11H8O2
平均分子量: 172.18 g/mol
单同位素质量: 172.0524295

名称与标识

首选名称: 5-Phenyl-2-furaldehyde
IUPAC: 5-phenylfuran-2-carbaldehyde
中文名: 5-苯基-2-糠醛
英文名: 5-Phenyl-2-furaldehyde
分子式: C11H8O2
分子量: 172.18

名称与别名

5-Phenyl-2-furaldehyde13803-39-9DTXSID20377726RefChem:304641DTXCID80328754626-945-45-phenylfuran-2-carbaldehyde2-Formyl-5-phenylfuran2-Furancarboxaldehyde, 5-phenyl-MFCD019101615-phenylfurfural5-Phenyl-furan-2-carbaldehyde

展开更多名称

5-苯基-2-糖醛5-苯基-2-糠醛5-苯基呋喃-2-甲醛5-苯基-2-呋喃甲醛5-苯基-2-糠醛 1GAKOS BAR-0555ASISCHEM R395115-Phenyl-2-furaldehyde 96%5-Phenyl-2-furancarboxaldehyde5-Phenyl-2-Furaldehyde(WXC00117)

5-Phenyl-2-furaldehyde, 96%AKOS000113829SB60974AC-18709SY101277Z572128582-Furancarboxaldehyde,5-phenyl-5-phenylfuraldehyde

数据库标识

CAS: 13803-39-9
PubChem CID: 2769420
DTXSID: DTXSID20377726
ChEMBL: CHEMBL4526187
EC Number: 626-945-4
Nikkaji: J1.138.756J

性质

结构计算性质

XLogP: 1.9
极性表面积: 30.2 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 2
重原子: 13
形式电荷: 0
复杂度: 173

物理化学性质

熔点: 29 · 29-33 °C (lit.)
沸点: 146 ℃ · 146℃ (5 Torr)
密度: 1.154 · 1.154±0.06 g/cm3(Predicted)
闪点: 230 °F · >230 °F
储存条件: 2 · under inert gas (nitrogen or Argon) at 2–8 °C
形态: Solid or Lliquid
颜色: Yellow to green to brown
InChI: 1S/C11H8O2/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-8H
InChIKey: BMJHNNPEPBZULA-UHFFFAOYSA-N
SMILES: O=Cc1ccc(o1)-c2ccccc2
CAS 数据库: 13803 · 13803-39-9(CAS DataBase Reference)

安全与法规

GHS分类

GHS Classification · 4 条

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危害信息

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

安全数据

wgk: 3
存储类别: 11 - Combustible Solids
安全说明: 26-36
海关编码: 2932190090
危险品标志: Xi
危险性类别: Eye Irrit. 2Skin Irrit. 2STOT SE 3
危险类别码: 36/37/38

化学与工业

上下游产品信息

上游原料

5-碘-2-呋喃甲醛 5-氯-2-糠醛三苯基铋 5-溴-2-呋喃甲醛 2-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione 5-甲醛基呋喃-2-硼酸苯硼酸苯胺碘苯三丁基苯基锡

试剂价格

XW021380339902 · 1G: 5-苯基-2-糠醛 — 166元
XW021380339901 · 250MG: 5-苯基-2-糠醛 — 45元

供应商50 家

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

成都市久鼎化学技术有限公司18584079237 · [email protected]

上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

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