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20914-21-0 | Cyanamide, N-butyl-N-phenyl-
CAS No: 20914-21-0 Catalog No: AG002K26 MDL No:
Product Description
Catalog Number:
AG002K26
Chemical Name:
Cyanamide, N-butyl-N-phenyl-
CAS Number:
20914-21-0
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
IUPAC Name:
butyl(phenyl)cyanamide
InChI:
InChI=1S/C11H14N2/c1-2-3-9-13(10-12)11-7-5-4-6-8-11/h4-8H,2-3,9H2,1H3
InChI Key:
SMPBBSKNRFYRRN-UHFFFAOYSA-N
SMILES:
CCCCN(c1ccccc1)C#N
NSC Number:
46339
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.247g/mol
Monoisotopic Mass:
174.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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