CAS: 5470-70-2
名称: methyl 6-methylpyridine-3-carboxylate
SMILES:
CC1=NC=C(C=C1)C(=O)OC分子加工
分子式
C8H9NO2
分子量
151.16
精确质量
151.0633
XLogP
1.18
TPSA
39.19
氢键给体数
0
氢键受体数
3
可旋转键
1
重原子数
11
环数
1
芳香环
1
饱和环
0
脂环
0
立体中心
0
未定义立体
0
形式电荷
0
杂原子数
3
共价单元
1
sp3占比
0.25
摩尔折射率
40.31
补充信息
InChIKey: VYPPZXZHYDSBSJ-UHFFFAOYSA-N
同义词
Methyl 6-methylnicotinateMethyl 6-methylpyridine-3-carboxylateDTXSID80282781RefChem:817435DTXCID00233932611-187-95470-70-2methyl-6-methylnicotinate6-Methylnicotinic Acid Methyl EsterMFCD00006340Etoricoxib impurity E6-methyl-nicotinic acid methyl ester3-(Methoxycarbonyl)-6-methylpyridineNSC-27973Methyl 6-methyl-3-pyridinecarboxylatemethyl 6-methylaminonicotinate3-pyridinecarboxylic acid, 6-methyl-, methyl esterYA0K0CM5PK6-Methylpyridine-3-carboxylic Acid Methyl Ester6-Methyl(pyridine-3-carboxylic acid)methyl estermethyl 6-methyl nicotinate6-Methyl-3-pyridinecarboxylic acid methyl ester6-methyl nicotinic acid methyl esterEtoricoxib Impurity 28UNII-YA0K0CM5PKNSC27973Methyl-6-methylnictinateSCHEMBL64763orb3030322SCHEMBL1505229
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