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132577-23-2 | Butanoic acid, 2-[2-(4-hydroxyphenyl)hydrazinylidene]-3-oxo-, ethyl ester
CAS No: 132577-23-2 Catalog No: AG0010UP MDL No:
Product Description
Catalog Number:
AG0010UP
Chemical Name:
Butanoic acid, 2-[2-(4-hydroxyphenyl)hydrazinylidene]-3-oxo-, ethyl ester
CAS Number:
132577-23-2
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
IUPAC Name:
ethyl 3-hydroxy-2-[(4-hydroxyphenyl)diazenyl]but-2-enoate
InChI:
InChI=1S/C12H14N2O4/c1-3-18-12(17)11(8(2)15)14-13-9-4-6-10(16)7-5-9/h4-7,15-16H,3H2,1-2H3
InChI Key:
LHCCVJIVDUBHRD-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=NNc1ccc(cc1)O)C(=O)C
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
250.254g/mol
Monoisotopic Mass:
250.095g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
91.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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