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2089-31-8 | Ethanone, 1-[4-(1-methylethyl)phenyl]-, oxime
CAS No: 2089-31-8 Catalog No: AG002JYA MDL No:
Product Description
Catalog Number:
AG002JYA
Chemical Name:
Ethanone, 1-[4-(1-methylethyl)phenyl]-, oxime
CAS Number:
2089-31-8
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
IUPAC Name:
N-[1-(4-propan-2-ylphenyl)ethylidene]hydroxylamine
InChI:
InChI=1S/C11H15NO/c1-8(2)10-4-6-11(7-5-10)9(3)12-13/h4-8,13H,1-3H3
InChI Key:
CIRGNVSWLZMWDT-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C(=NO)C)C
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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