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101577-96-2 | Guanidine, N,N'-bis(2-ethylphenyl)-
CAS No: 101577-96-2 Catalog No: AG0004US MDL No:
Product Description
Catalog Number:
AG0004US
Chemical Name:
Guanidine, N,N'-bis(2-ethylphenyl)-
CAS Number:
101577-96-2
Molecular Formula:
C17H21N3
Molecular Weight:
267.3687
IUPAC Name:
1,2-bis(2-ethylphenyl)guanidine
InChI:
InChI=1S/C17H21N3/c1-3-13-9-5-7-11-15(13)19-17(18)20-16-12-8-6-10-14(16)4-2/h5-12H,3-4H2,1-2H3,(H3,18,19,20)
InChI Key:
AJNXCTFYCKDBPU-UHFFFAOYSA-N
SMILES:
CCc1ccccc1NC(=N)Nc1ccccc1CC
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.174g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.376g/mol
Monoisotopic Mass:
267.174g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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