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90942-89-5 | Cyclohexanecarboxylic acid, 4-(hydroxyimino)-, ethyl ester
CAS No: 90942-89-5 Catalog No: AG006GAG MDL No:MFCD28096657
Product Description
Catalog Number:
AG006GAG
Chemical Name:
Cyclohexanecarboxylic acid, 4-(hydroxyimino)-, ethyl ester
CAS Number:
90942-89-5
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
MDL Number:
MFCD28096657
IUPAC Name:
ethyl 4-hydroxyiminocyclohexane-1-carboxylate
InChI:
InChI=1S/C9H15NO3/c1-2-13-9(11)7-3-5-8(10-12)6-4-7/h7,12H,2-6H2,1H3
InChI Key:
DRENYNCPFOMTKK-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCC(=NO)CC1
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.223g/mol
Monoisotopic Mass:
185.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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