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144172-26-9 | 1H-Indene-2-carboxylic acid, 5-chloro-1-hydrazinylidene-2,3-dihydro-2-hydroxy-, methyl ester
CAS No: 144172-26-9 Catalog No: AG001J22 MDL No:
Product Description
Catalog Number:
AG001J22
Chemical Name:
1H-Indene-2-carboxylic acid, 5-chloro-1-hydrazinylidene-2,3-dihydro-2-hydroxy-, methyl ester
CAS Number:
144172-26-9
Molecular Formula:
C11H11ClN2O3
Molecular Weight:
254.6696
IUPAC Name:
methyl (3Z)-6-chloro-3-hydrazinylidene-2-hydroxy-1H-indene-2-carboxylate
InChI:
InChI=1S/C11H11ClN2O3/c1-17-10(15)11(16)5-6-4-7(12)2-3-8(6)9(11)14-13/h2-4,16H,5,13H2,1H3/b14-9-
InChI Key:
JCVOGCGLEKVMAX-ZROIWOOFSA-N
SMILES:
COC(=O)C1(O)Cc2c(C1=NN)ccc(c2)Cl
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
254.046g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
254.67g/mol
Monoisotopic Mass:
254.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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