Home Aminos Ethyl 4-amino-5-cyano-2-hydroxy-3-methylbenzoate

Ethyl 4-amino-5-cyano-2-hydroxy-3-methylbenzoate

CAS No.:
72817-85-7
Catalog Number:
AG0061JR
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
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Product Description
Catalog Number:
AG0061JR
Chemical Name:
Ethyl 4-amino-5-cyano-2-hydroxy-3-methylbenzoate
CAS Number:
72817-85-7
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD02089547
IUPAC Name:
ethyl 4-amino-5-cyano-2-hydroxy-3-methylbenzoate
InChI:
InChI=1S/C11H12N2O3/c1-3-16-11(15)8-4-7(5-12)9(13)6(2)10(8)14/h4,14H,3,13H2,1-2H3
InChI Key:
AREVECVPDJASFB-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(C#N)c(c(c1O)C)N
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
96.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties