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Methyl N-Boc-4-piperidinepropionate

HCID 1502093
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
162504-75-8
Standard SMILES
COC(=O)CCC1CCN(C(=O)OC(C)(C)C)CC1
InChIKey
RWDYQFGCHAJYOJ-UHFFFAOYSA-N
Molecular formula
C14H25NO4
Average molar mass
271.35 g/mol
Monoisotopic mass
271.17835828

Names & identifiers

Preferred name
Methyl N-Boc-4-piperidinepropionate
IUPAC
tert-butyl 4-(3-methoxy-3-oxopropyl)piperidine-1-carboxylate
English name
Methyl N-Boc-4-piperidinepropionate
Molecular formula
C14H25NO4
Molecular weight
271.35

Names & synonyms

162504-75-8Methyl N-Boc-4-piperidinepropionatetert-butyl 4-(3-methoxy-3-oxopropyl)piperidine-1-carboxylateMFCD021790131-Boc-4-piperidinepropanoic acid methyl ester4-Piperidinepropanoic acid, 1-[(1,1-dimethylethoxy)carbonyl]-, methyl estertert-butyl 4-(3-methoxy-3-oxo-propyl)piperidine-1-carboxylate1-[1,1-Dimethylethoxy)carbonyl]-4-piperidinepropanoic Acid Methyl Ester4-PiperidineproSCHEMBL594491orb3176700DTXSID90936703
Show more names
1-Boc-4-Piperidinylpropionic Acid Methyl EsterN-BOC-4-PIPERIDINYLPROPIONIC ACID METHYL ESTERtert-butyl 4-(2-(methoxycarbonyl)ethyl)piperidine-1-carboxylate1-[1,1-Dimethylethoxy)?carbonyl]?-?4-piperidinepropanoic Acid Methyl Ester
RWDYQFGCHAJYOJ-UHFFFAOYSA-NMethyl N-BOC-4-piperidine propionateAKOS015837018DS-1159SB43218Methyl 3-(1-Boc-4-piperidyl)propanoateSY103135DB-012015

Database identifiers

Properties

Computed structural properties

XLogP
2
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
19
Formal charge
0
Complexity
314

Physicochemical properties

Boiling point
339.2 · 339.2±15.0 °C(Predicted)
Density
1.048 · 1.048±0.06 g/cm3(Predicted)
storage temp.
Sealed in dry,Room Temperature
pka
-1.51 · -1.51±0.40(Predicted)
Appearance
White to off-white Solid
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses1-[1,1-Dimethylethoxy)carbonyl]-4-piperidinepropanoic Acid Methyl Ester is used to prepare arginylglycylaspartic acid derivatives as fibrinogen receptor antagonists.

Upstream & downstream products

Downstream products

1-Boc-piperidin-4-ylpropionic acid

Suppliers36 total

毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
郑州药领医药科技有限公司13526569071 · [email protected]
上海平创化工科技有限公司15001988657 15802146997
上海睿升化工科技有限公司+86-021-50935922
上海贺康生物技术有限公司17721021104 18939837085 · [email protected]

Related reactions

12 records
New reaction record
HRID 206928 reaction equation
HRID 206928As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 557697 reaction equation
HRID 557697As productuspto-grants-2011_11
HRID 557698 reaction equation
HRID 557698As reactantuspto-grants-2011_11
HRID 643568 reaction equation
HRID 643568As productuspto-grants-2010_04
HRID 643569 reaction equation
HRID 643569As reactantuspto-grants-2010_04
HRID 1282012 reaction equation
HRID 1282012As reactantuspto-grants-2002_09
HRID 1641774 reaction equation
HRID 1641774As productuspto-grants-2012_02
HRID 1641775 reaction equation
HRID 1641775As reactantuspto-grants-2012_02
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
CAS
162504-75-8
PubChem CID
1502093
DTXSID
DTXSID90936703
上海肯恩化学科技有限公司13120367189;18621755571 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
诺尔凯立科技有限公司86-(0)21-31261262 373522135 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
泰安市嘉叶生物科技有限公司15318151873;13127280945 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
上海相辉医药科技有限公司[email protected]
上海凯乐迪亚生物医药有限公司021-18800336901 18800336901 · [email protected]
上海新作博生物医药科技有限公司021-18800336901 15821600833
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海肯恩化学科技有限公司13701870891; 02152215958 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
Mainchem Co., Ltd.+86-86-05926210733 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
南京药石科技股份有限公司4000255188 · [email protected]