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Home > Nitro Compounds > 136499-29-1
136499-29-1 | 2-Thiazolidinone, 3-[(2-nitrophenyl)methyl]-
CAS No: 136499-29-1 Catalog No: AG0011WR MDL No:
Product Description
Catalog Number:
AG0011WR
Chemical Name:
2-Thiazolidinone, 3-[(2-nitrophenyl)methyl]-
CAS Number:
136499-29-1
Molecular Formula:
C10H10N2O3S
Molecular Weight:
238.2630
IUPAC Name:
3-[(2-nitrophenyl)methyl]-1,3-thiazolidin-2-one
InChI:
InChI=1S/C10H10N2O3S/c13-10-11(5-6-16-10)7-8-3-1-2-4-9(8)12(14)15/h1-4H,5-7H2
InChI Key:
REJNNJJROLKACD-UHFFFAOYSA-N
SMILES:
O=C1SCCN1Cc1ccccc1[N+](=O)[O-]
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.041g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.261g/mol
Monoisotopic Mass:
238.041g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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