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10135-23-6 | 2-Pyrrolidinone, 1-(2-phenylethyl)-
CAS No: 10135-23-6 Catalog No: AG0004B1 MDL No:MFCD01605540
Product Description
Catalog Number:
AG0004B1
Chemical Name:
2-Pyrrolidinone, 1-(2-phenylethyl)-
CAS Number:
10135-23-6
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD01605540
IUPAC Name:
1-(2-phenylethyl)pyrrolidin-2-one
InChI:
InChI=1S/C12H15NO/c14-12-7-4-9-13(12)10-8-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2
InChI Key:
GKZJJXFFNOSPHJ-UHFFFAOYSA-N
SMILES:
O=C1CCCN1CCc1ccccc1
EC Number:
600-195-8
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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