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102613-42-3 | Urea, N-[(4-methoxy-1-naphthalenyl)methyl]-
CAS No: 102613-42-3 Catalog No: AG0007XZ MDL No:
Product Description
Catalog Number:
AG0007XZ
Chemical Name:
Urea, N-[(4-methoxy-1-naphthalenyl)methyl]-
CAS Number:
102613-42-3
Molecular Formula:
C13H14N2O2
Molecular Weight:
230.2625
IUPAC Name:
1-(4-methoxynaphthalen-1-yl)-3-methylurea
InChI:
InChI=1S/C13H14N2O2/c1-14-13(16)15-11-7-8-12(17-2)10-6-4-3-5-9(10)11/h3-8H,1-2H3,(H2,14,15,16)
InChI Key:
HOTQCDOWCCRBHP-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cccc2)CNC(=O)N
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.267g/mol
Monoisotopic Mass:
230.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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