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Home > Nitro Compounds > 1164508-39-7
1164508-39-7 | (2Z)-2-(nitromethylidene)-3-phenyl-1,3-thiazolidin-4-one
CAS No: 1164508-39-7 Catalog No: AG00ITRU MDL No:MFCD01935899
Product Description
Catalog Number:
AG00ITRU
Chemical Name:
(2Z)-2-(nitromethylidene)-3-phenyl-1,3-thiazolidin-4-one
CAS Number:
1164508-39-7
Molecular Formula:
C10H8N2O3S
Molecular Weight:
236.2471
MDL Number:
MFCD01935899
IUPAC Name:
2-(nitromethylidene)-3-phenyl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C10H8N2O3S/c13-9-7-16-10(6-11(14)15)12(9)8-4-2-1-3-5-8/h1-6H,7H2
InChI Key:
WZAJGYJJKCRCCZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)/C=C/1\SCC(=O)N1c1ccccc1
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.026g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.245g/mol
Monoisotopic Mass:
236.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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