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933704-48-4 | 2-[(1,3-thiazol-2-yl)methyl]piperidine
CAS No: 933704-48-4 Catalog No: AG01BT2U MDL No:MFCD23776458
Product Description
Catalog Number:
AG01BT2U
Chemical Name:
2-[(1,3-thiazol-2-yl)methyl]piperidine
CAS Number:
933704-48-4
Molecular Formula:
C9H14N2S
Molecular Weight:
182.2859
MDL Number:
MFCD23776458
IUPAC Name:
2-(piperidin-2-ylmethyl)-1,3-thiazole
InChI:
InChI=1S/C9H14N2S/c1-2-4-10-8(3-1)7-9-11-5-6-12-9/h5-6,8,10H,1-4,7H2
InChI Key:
ULBZJAZIIPQWOG-UHFFFAOYSA-N
SMILES:
C1CCC(NC1)Cc1nccs1
Properties
Complexity:
141
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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