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23196-06-7 | 2-Pyrrolidinone, 1-(2-methoxyphenyl)-
CAS No: 23196-06-7 Catalog No: AG002MI2 MDL No:
Product Description
Catalog Number:
AG002MI2
Chemical Name:
2-Pyrrolidinone, 1-(2-methoxyphenyl)-
CAS Number:
23196-06-7
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
IUPAC Name:
1-(2-methoxyphenyl)pyrrolidin-2-one
InChI:
InChI=1S/C11H13NO2/c1-14-10-6-3-2-5-9(10)12-8-4-7-11(12)13/h2-3,5-6H,4,7-8H2,1H3
InChI Key:
SMBILOIZRKUZPE-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CCCC1=O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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