N-(1-苯基乙基)乙酰胺 | 36065-27-7
中文名称:
N-(1-苯基乙基)乙酰胺
英文名称:
N-(1-Phenylethyl)acetamide
CAS No.:
36065-27-7
分子式:
C1 0 H1 3 NO
分子量:
163.21600
名称和标识符
MDL
MFCD00040690
InChIKey
PAVMRYVMZLANOQ-UHFFFAOYSA-N
Inchi
InChI=1S/C10H13NO/c1-8(11-9(2)12)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,11,12)
SMILES
CC(NC(C)=O)C1=CC=CC=C1
别名信息
- 中文别名 -
N-(1-苯乙基)乙酰胺
N-(1-苯基乙基)乙酰胺
- 英文别名 -
Acetamide, N- (.alpha.-methylbenzyl)-
DL-N-acetyl-α-methylbenzylamine
N-(1-phenylethyl)Acetamide
(+)-N-(1-phenylethyl)acetamide
N-acetyl-1-phenylethylamine
N-phenylethylacetamide
N-α-methylbenzylacetamide
PhCH(NHAc)CH3
(+)-N-(1-Phenylethyl)acetamide
SY317424
36065-27-7
NSC-7176
SY007036
CS-0154001
SCHEMBL540666
N-alpha-phenylethylacetamide
Maybridge4_001980
Cambridge id 5108520
CCG-48340
MFCD03427633
n-acetyl-1-phenylethylamine
SB46741
BRD-A76290955-001-01-6
N-(1-Phenyl-ethyl)-acetamide
BS-16659
AKOS000494156
6284-14-6
MFCD00040690
CHEBI:141185
N-(1-Phenylethyl)acetamide #
NCGC00177051-01
EN300-1663403
Acetamide, N-(1-phenylethyl)-
racemic N-acetyl 1-phenylethylamine
FT-0637797
SR-01000637890-1
Acetamide, N-(.alpha.-methylbenzyl)-
FT-0693704
NSC7176
AC2474
AKOS016374419
racemic N-acetyl-1-phenylethylamine
A868342
A918552
N-(1-Phenylethyl)acetamide
SB76014
N-alpha-methylbenzylacetamide
HMS1526J22
FT-0639311
N-(alpha-Methylbenzyl)acetamide
SB76100
FT-0720595
Linifanib
ABT-869
物化性质
实验特性
LogP
2.27460
PSA
29.10000
计算特性
精确分子量
163.10000
氢键供体数量
1
氢键受体数量
2
可旋转化学键数量
3
同位素质量
163.099714038g/mol
重原子数量
12
复杂度
150
同位素原子数量
0
确定原子立构中心数量
0
不确定原子立构中心数量
1
确定化学键立构中心数量
0
不确定化学键立构中心数量
0
共价键单元数量
1
疏水参数计算参考值(XlogP)
1.4
拓扑分子极性表面积
29.1Ų
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