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51052-78-9

51052-78-9 | 2-(Piperidin-4-yl)acetic acid

CAS No: 51052-78-9 Catalog No: AG003LZQ MDL No:MFCD02093097

Product Description

Catalog Number:
AG003LZQ
Chemical Name:
2-(Piperidin-4-yl)acetic acid
CAS Number:
51052-78-9
Molecular Formula:
C7H13NO2
Molecular Weight:
143.1836
MDL Number:
MFCD02093097
IUPAC Name:
2-piperidin-4-ylacetic acid
InChI:
InChI=1S/C7H13NO2/c9-7(10)5-6-1-3-8-4-2-6/h6,8H,1-5H2,(H,9,10)
InChI Key:
YFNOTMRKVGZZNF-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCNCC1
UNII:
IV2WOE5J01

Properties

Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
143.186g/mol
Monoisotopic Mass:
143.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.2  

Literature

Title Journal
Synthesis of novel 4,1-benzoxazepine derivatives as squalene synthase inhibitors and their inhibition of cholesterol synthesis. Journal of medicinal chemistry 20020926

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