111309
1-苯基-1-丙醇
≥97%
别名:
α-苯丙醇, (±)-1-苯丙醇
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关于此项目
线性分子式:
C2H5CH(C6H5)OH
化学文摘社编号:
分子量:
136.19
NACRES:
NA.22
PubChem Substance ID:
eCl@ss:
39023126
UNSPSC Code:
12352100
EC Number:
202-256-0
MDL number:
Beilstein/REAXYS Number:
1906759
Assay:
≥97%
Quality Segment
assay
≥97%
refractive index
n20/D 1.52 (lit.)
bp
103 °C/14 mmHg (lit.)
density
0.994 g/mL at 25 °C (lit.)
functional group
hydroxyl, phenyl
SMILES string
CCC(O)c1ccccc1
InChI
1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3
InChI key
DYUQAZSOFZSPHD-UHFFFAOYSA-N
General description
1-苯基-1-丙醇对映体（E-PP）形成环十肽（CDP）包合物，已利用密度泛函理论（DFT）B3LYP方法对其进行研究。它还用于确定质量转移动力学对Chiracel OB（包被在硅胶上的三苯甲酸纤维素）上1-苯基-1-丙醇（PP）对映体的洗脱曲线的影响。
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
194.0 °F - closed cup
flash_point_c
90 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter