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1353944-35-0 | [(1-Acetyl-pyrrolidin-3-ylmethyl)-amino]-acetic acid
CAS No: 1353944-35-0 Catalog No: AG01F8HI MDL No:
Product Description
Catalog Number:
AG01F8HI
Chemical Name:
[(1-Acetyl-pyrrolidin-3-ylmethyl)-amino]-acetic acid
CAS Number:
1353944-35-0
Molecular Formula:
C9H16N2O3
Molecular Weight:
200.2349
IUPAC Name:
2-[(1-acetylpyrrolidin-3-yl)methylamino]acetic acid
InChI:
InChI=1S/C9H16N2O3/c1-7(12)11-3-2-8(6-11)4-10-5-9(13)14/h8,10H,2-6H2,1H3,(H,13,14)
InChI Key:
DPGFLYUOWDWLPC-UHFFFAOYSA-N
SMILES:
OC(=O)CNCC1CCN(C1)C(=O)C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.116g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.238g/mol
Monoisotopic Mass:
200.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-3
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