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113963-36-3 | 1H-Pyrrolizin-1-one, 7-(ethoxymethyl)-2,3-dihydro-
CAS No: 113963-36-3 Catalog No: AG000A5P MDL No:
Product Description
Catalog Number:
AG000A5P
Chemical Name:
1H-Pyrrolizin-1-one, 7-(ethoxymethyl)-2,3-dihydro-
CAS Number:
113963-36-3
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
IUPAC Name:
7-(ethoxymethyl)-2,3-dihydropyrrolizin-1-one
InChI:
InChI=1S/C10H13NO2/c1-2-13-7-8-3-5-11-6-4-9(12)10(8)11/h3,5H,2,4,6-7H2,1H3
InChI Key:
NTULMWBHQQDSNT-UHFFFAOYSA-N
SMILES:
CCOCc1ccn2c1C(=O)CC2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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