Home Carbonyls Benzoic acid, 4-[(aminocarbonyl)amino]-, ethyl ester

Benzoic acid, 4-[(aminocarbonyl)amino]-, ethyl ester

CAS No.:
13289-38-8
Catalog Number:
AG0011CY
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
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Product Description
Catalog Number:
AG0011CY
Chemical Name:
Benzoic acid, 4-[(aminocarbonyl)amino]-, ethyl ester
CAS Number:
13289-38-8
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD02379956
IUPAC Name:
ethyl 4-(carbamoylamino)benzoate
InChI:
InChI=1S/C10H12N2O3/c1-2-15-9(13)7-3-5-8(6-4-7)12-10(11)14/h3-6H,2H2,1H3,(H3,11,12,14)
InChI Key:
HLVGAFHZUPLCML-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)NC(=O)N
NSC Number:
262636
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties