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133081-23-9 | Benzoic acid, 4-hydrazinyl-, 2,5-dioxo-1-pyrrolidinyl ester, hydrochloride (1:1)
CAS No: 133081-23-9 Catalog No: AG001481 MDL No:
Product Description
Catalog Number:
AG001481
Chemical Name:
Benzoic acid, 4-hydrazinyl-, 2,5-dioxo-1-pyrrolidinyl ester, hydrochloride (1:1)
CAS Number:
133081-23-9
Molecular Formula:
C11H12ClN3O4
Molecular Weight:
285.6837
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) 4-hydrazinylbenzoate
InChI:
InChI=1S/C11H11N3O4/c12-13-8-3-1-7(2-4-8)11(17)18-14-9(15)5-6-10(14)16/h1-4,13H,5-6,12H2
InChI Key:
FSWGOICFRWDKMZ-UHFFFAOYSA-N
SMILES:
NNc1ccc(cc1)C(=O)ON1C(=O)CCC1=O.Cl
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.075g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.226g/mol
Monoisotopic Mass:
249.075g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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