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754214-00-1

754214-00-1 | Guanidine, (4-methyl-3-nitrophenyl)-

CAS No: 754214-00-1 Catalog No: AG005LFL MDL No:

Product Description

Catalog Number:
AG005LFL
Chemical Name:
Guanidine, (4-methyl-3-nitrophenyl)-
CAS Number:
754214-00-1
Molecular Formula:
C8H10N4O2
Molecular Weight:
194.1906
IUPAC Name:
2-(4-methyl-3-nitrophenyl)guanidine
InChI:
InChI=1S/C8H10N4O2/c1-5-2-3-6(11-8(9)10)4-7(5)12(13)14/h2-4H,1H3,(H4,9,10,11)
InChI Key:
ZDGOBULKEQZSPT-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1ccc(c(c1)[N+](=O)[O-])C

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.08g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.194g/mol
Monoisotopic Mass:
194.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

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