4-苯基-4-哌啶甲酸

4-苯基-4-哌啶甲酸 基本信息
CAS号 3627-45-0 分子式 C12H15NO2
分子量 205.25300 精确质量  205.11000
PSA  49.33000 LogP  1.72120

基本信息 展开↓

CAS号:
3627-45-0
3D弹球模型:
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分子式:
C12H15NO2
分子量:
205.25300
中文名称:
4-苯基-4-哌啶甲酸
英文名称:
4-PHENYL-4-PIPERIDINE CARBOXYLIC ACID
中文别名:
4-苯基-4-哌啶甲酸;
C.I. Acid Brown 2;
Sodium 4-hydroxy-3-((2-methoxy-5-nitrophenyl)azo)-6-(phenylamino)naphthalene-2-sulphonate;
sodium (3Z)-3-[2-(2-methoxy-5-nitrophenyl)hydrazinylidene]-4-oxo-6-(phenylamino)-3,4-dihydronaphthalene-2-sulfonate;
Acid Brown 2;
DIRECT ORANG 26;
disodium (3E)-4-oxo-7-({[(6E)-5-oxo-6-(2-phenylhydrazinylidene)-7-sulfonato-5,6-dihydronaphthalen-2-yl]carbamoyl}amino)-3-(2-phenylhydrazinylidene)-3,4-dihydronaphthalene-2-sulfonate;
Direct Orange S;
Acid Mordant Navy Blue RRL;
disodium (6E)-6-[2-(5-chloro-2-hydroxy-3-sulfonatophenyl)hydrazinylidene]-5-oxo-5,6-dihydronaphthalene-1-sulfonate;
6-(5-Chloro-2-Hydroxy-4-Sulfophenylazo)-5-Hydroxy-1-Naphthalenesulfonic Acid Disodium Salt;
Mordant Blue 9;
Alpha L-Rhamnose;
alpha-6-Deoxy-L-mannose;
alpha-L-Mannomethylose;
alpha-L-Rhamnopyranose;
Alpha-L-Rhamnose;
6-deoxy-L-mannose;
R-874 phillips;
2-(octylsulfanyl)ethanol;
3,3'-(sulfanediyldimethanediyl)dinonan-2-ol;
2-(octylthio)ethanol;
NSC 263364;
Neo-erycinum;
PELS;
Propionic acid, 2'-ester with erythromycin, dodecyl s
英文别名:
4-PHENYL-4-PIPERIDINE CARBOXYLIC ACID;
4-phenylpiperidine-4-carboxylic acid hydrochloride;
Normeperidine acid;
n-demthylmeperidinicacid;
4-carboxy-4-phenyl-piperidin;
normeperidinicacid;
4-Phenyl-piperidin-4-carbonsaeure;
4-Phenyl-4-piperidinecarboxylic acid HCl;
4-phenylisonipecotic acid;
4-hydroxycarbonyl-4-phenyl-piperidine;
4-phenyl-4-piperidinecarboxylicaci;
4-phenyl-isonipecoticaci;
Norpethidinic acid;
4-phenylpiperidine-4-carboxylicacid
精确分子量/精确质量:
205.11000
极性分子表面积/PSA:
49.33000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
EINECS:
222-844-0
InChI:
InChI=1/C12H15NO2/c14-11(15)12(6-8-13-9-7-12)10-4-2-1-3-5-10/h1-5,13H,6-9H2,(H,14,15)

物化性质展开↓

密度:
1.157g/cm3
沸点:
374.9ºC at 760mmHg
闪点:
180.5ºC
折射率:
1.554

安全信息展开↓

海关代码:
2933399090

合成路线查看所有的合成路线

  • 61886-17-7

    1-苄基-4-苯基哌啶-4-羧酸

  • ~96%

  • 3627-45-0

    4-苯基-4-哌啶甲酸

  • 167262-68-2

    保护的4-苯基哌啶-4-羧酸

  • ~90%

  • 3627-45-0

    4-苯基-4-哌啶甲酸

  • 181641-61-2

    4-phenyl-1-phenylmethoxycarbonylpiperidine-4-carboxylic acid

  • ~77%

  • 3627-45-0

    4-苯基-4-哌啶甲酸

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NS6190000
CHEMICAL NAME :
Isonipecotic acid, 4-phenyl-
CAS REGISTRY NUMBER :
3627-45-0
BEILSTEIN REFERENCE NO. :
0171176
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-N-O2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
89 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#12027

海关数据查看详细

中国海关编码:2933399090

概述:
2933399090. 其他结构含非稠合吡啶环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期
摘要/Summary:
2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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