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767246-73-1 | 3(2H)-Isoxazolone,5-(1-pyrrolidinylmethyl)-(9CI)
CAS No: 767246-73-1 Catalog No: AG00GDRF MDL No:
Product Description
Catalog Number:
AG00GDRF
Chemical Name:
3(2H)-Isoxazolone,5-(1-pyrrolidinylmethyl)-(9CI)
CAS Number:
767246-73-1
IUPAC Name:
5-(pyrrolidin-1-ylmethyl)-1,2-oxazol-3-one
InChI:
InChI=1S/C8H12N2O2/c11-8-5-7(12-9-8)6-10-3-1-2-4-10/h5H,1-4,6H2,(H,9,11)
InChI Key:
NSIOOUOYFCIQJP-UHFFFAOYSA-N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.196g/mol
Monoisotopic Mass:
168.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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