Home Other Building Blocks 5-(hydroxymethyl)-5-(propan-2-yl)piperidin-2-one

5-(hydroxymethyl)-5-(propan-2-yl)piperidin-2-one

CAS No.:
1909337-78-5
Catalog Number:
AG01C2PU
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
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Product Description
Catalog Number:
AG01C2PU
Chemical Name:
5-(hydroxymethyl)-5-(propan-2-yl)piperidin-2-one
CAS Number:
1909337-78-5
Molecular Formula:
C9H17NO2
Molecular Weight:
171.2368
MDL Number:
MFCD29055096
IUPAC Name:
5-(hydroxymethyl)-5-propan-2-ylpiperidin-2-one
InChI:
InChI=1S/C9H17NO2/c1-7(2)9(6-11)4-3-8(12)10-5-9/h7,11H,3-6H2,1-2H3,(H,10,12)
InChI Key:
ZQRGYHSYXFZONZ-UHFFFAOYSA-N
SMILES:
OCC1(CCC(=O)NC1)C(C)C
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.126g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.24g/mol
Monoisotopic Mass:
171.126g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties