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75179-75-8 | 1-[4-(azetidin-1-yl)but-2-ynyl]pyrrolidin-2-one
CAS No: 75179-75-8 Catalog No: AG005DTX MDL No:
Product Description
Catalog Number:
AG005DTX
Chemical Name:
1-[4-(azetidin-1-yl)but-2-ynyl]pyrrolidin-2-one
CAS Number:
75179-75-8
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
IUPAC Name:
1-[4-(azetidin-1-yl)but-2-ynyl]pyrrolidin-2-one
InChI:
InChI=1S/C11H16N2O/c14-11-5-3-10-13(11)9-2-1-6-12-7-4-8-12/h3-10H2
InChI Key:
ZOQXZSBVIOSOGM-UHFFFAOYSA-N
SMILES:
O=C1CCCN1CC#CCN1CCC1
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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