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123403-56-5 | Guanidine, N,N'-bis(3-ethylphenyl)-
CAS No: 123403-56-5 Catalog No: AG000KJA MDL No:
Product Description
Catalog Number:
AG000KJA
Chemical Name:
Guanidine, N,N'-bis(3-ethylphenyl)-
CAS Number:
123403-56-5
Molecular Formula:
C17H21N3
Molecular Weight:
267.3687
IUPAC Name:
1,2-bis(3-ethylphenyl)guanidine
InChI:
InChI=1S/C17H21N3/c1-3-13-7-5-9-15(11-13)19-17(18)20-16-10-6-8-14(4-2)12-16/h5-12H,3-4H2,1-2H3,(H3,18,19,20)
InChI Key:
HCXWPWPGUTZRDL-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1)NC(=N)Nc1cccc(c1)CC
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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