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Home > Thiazole > 1017163-98-2
1017163-98-2 | 2-(piperidin-4-ylmethyl)thiazole
CAS No: 1017163-98-2 Catalog No: AG01C09Y MDL No:MFCD09891834
Product Description
Catalog Number:
AG01C09Y
Chemical Name:
2-(piperidin-4-ylmethyl)thiazole
CAS Number:
1017163-98-2
Molecular Formula:
C9H14N2S
Molecular Weight:
182.2859
MDL Number:
MFCD09891834
IUPAC Name:
2-(piperidin-4-ylmethyl)-1,3-thiazole
InChI:
InChI=1S/C9H14N2S/c1-3-10-4-2-8(1)7-9-11-5-6-12-9/h5-6,8,10H,1-4,7H2
InChI Key:
WJVMBLXNPUNVRW-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)Cc1nccs1
Properties
Complexity:
135
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.088g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.285g/mol
Monoisotopic Mass:
182.088g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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