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114039-81-5 | 2-Propen-1-one, 3-(4-chlorophenyl)-1-(2-naphthalenyl)-, oxime
CAS No: 114039-81-5 Catalog No: AG000ACB MDL No:
Product Description
Catalog Number:
AG000ACB
Chemical Name:
2-Propen-1-one, 3-(4-chlorophenyl)-1-(2-naphthalenyl)-, oxime
CAS Number:
114039-81-5
Molecular Formula:
C19H14ClNO
Molecular Weight:
307.7736
IUPAC Name:
N-[3-(4-chlorophenyl)-1-naphthalen-2-ylprop-2-enylidene]hydroxylamine
InChI:
InChI=1S/C19H14ClNO/c20-18-10-5-14(6-11-18)7-12-19(21-22)17-9-8-15-3-1-2-4-16(15)13-17/h1-13,22H
InChI Key:
NCGJQUSDWKIAJO-UHFFFAOYSA-N
SMILES:
ON=C(c1ccc2c(c1)cccc2)C=Cc1ccc(cc1)Cl
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.076g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.777g/mol
Monoisotopic Mass:
307.076g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.8
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