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17826-33-4 | Guanidine, N-(3,4-dichlorophenyl)-N'-ethyl-
CAS No: 17826-33-4 Catalog No: AG0025W1 MDL No:
Product Description
Catalog Number:
AG0025W1
Chemical Name:
Guanidine, N-(3,4-dichlorophenyl)-N'-ethyl-
CAS Number:
17826-33-4
Molecular Formula:
C9H11Cl2N3
Molecular Weight:
232.1097
IUPAC Name:
1-(3,4-dichlorophenyl)-2-ethylguanidine
InChI:
InChI=1S/C9H11Cl2N3/c1-2-13-9(12)14-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H3,12,13,14)
InChI Key:
OZFOQJXRULGYKB-UHFFFAOYSA-N
SMILES:
CCNC(=N)Nc1ccc(c(c1)Cl)Cl
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.108g/mol
Monoisotopic Mass:
231.033g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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