Home Aminos 1-(3-aminophenyl)-3,3-dimethylurea

1-(3-aminophenyl)-3,3-dimethylurea

CAS No.:
39938-79-9
Catalog Number:
AG01BG4X
Molecular Formula:
C9H13N3O
Molecular Weight:
179.2190
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Product Description
Catalog Number:
AG01BG4X
Chemical Name:
1-(3-aminophenyl)-3,3-dimethylurea
CAS Number:
39938-79-9
Molecular Formula:
C9H13N3O
Molecular Weight:
179.2190
MDL Number:
MFCD11125448
IUPAC Name:
3-(3-aminophenyl)-1,1-dimethylurea
InChI:
InChI=1S/C9H13N3O/c1-12(2)9(13)11-8-5-3-4-7(10)6-8/h3-6H,10H2,1-2H3,(H,11,13)
InChI Key:
MZCIMHCGCFGWJS-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)NC(=O)N(C)C
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.106g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.223g/mol
Monoisotopic Mass:
179.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties