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1353974-47-6 | [(1-Acetyl-piperidin-3-ylmethyl)-amino]-acetic acid
CAS No: 1353974-47-6 Catalog No: AG01F8RT MDL No:
Product Description
Catalog Number:
AG01F8RT
Chemical Name:
[(1-Acetyl-piperidin-3-ylmethyl)-amino]-acetic acid
CAS Number:
1353974-47-6
Molecular Formula:
C10H18N2O3
Molecular Weight:
214.2615
IUPAC Name:
2-[(1-acetylpiperidin-3-yl)methylamino]acetic acid
InChI:
InChI=1S/C10H18N2O3/c1-8(13)12-4-2-3-9(7-12)5-11-6-10(14)15/h9,11H,2-7H2,1H3,(H,14,15)
InChI Key:
SVPUQBJOMZRTTC-UHFFFAOYSA-N
SMILES:
OC(=O)CNCC1CCCN(C1)C(=O)C
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.132g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.265g/mol
Monoisotopic Mass:
214.132g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.6
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