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13114-62-0 | Urea, N-2-naphthalenyl-
CAS No: 13114-62-0 Catalog No: AG000VME MDL No:
Product Description
Catalog Number:
AG000VME
Chemical Name:
Urea, N-2-naphthalenyl-
CAS Number:
13114-62-0
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
IUPAC Name:
naphthalen-2-ylurea
InChI:
InChI=1S/C11H10N2O/c12-11(14)13-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H3,12,13,14)
InChI Key:
MRSYBIDUQWAWBO-UHFFFAOYSA-N
SMILES:
NC(=O)Nc1ccc2c(c1)cccc2
EC Number:
236-038-1
NSC Number:
406079
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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