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116120-22-0 | Cyanamide, N-2-naphthalenyl-
CAS No: 116120-22-0 Catalog No: AG000BP1 MDL No:
Product Description
Catalog Number:
AG000BP1
Chemical Name:
Cyanamide, N-2-naphthalenyl-
CAS Number:
116120-22-0
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
IUPAC Name:
naphthalen-2-ylcyanamide
InChI:
InChI=1S/C11H8N2/c12-8-13-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,13H
InChI Key:
ZKBKZMHZLLGFLS-UHFFFAOYSA-N
SMILES:
N#CNc1ccc2c(c1)cccc2
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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