Home Carboxys 1,3-dimethyl 5-amino-4-hydroxybenzene-1,3-dicarboxylate

1,3-dimethyl 5-amino-4-hydroxybenzene-1,3-dicarboxylate

CAS No.:
99060-94-3
Catalog Number:
AG01EMMM
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
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Product Description
Catalog Number:
AG01EMMM
Chemical Name:
1,3-dimethyl 5-amino-4-hydroxybenzene-1,3-dicarboxylate
CAS Number:
99060-94-3
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
MDL Number:
MFCD31665772
IUPAC Name:
dimethyl 5-amino-4-hydroxybenzene-1,3-dicarboxylate
InChI:
InChI=1S/C10H11NO5/c1-15-9(13)5-3-6(10(14)16-2)8(12)7(11)4-5/h3-4,12H,11H2,1-2H3
InChI Key:
UUYVNTDBTBWXJI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(N)c(c(c1)C(=O)OC)O
Properties
Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.064g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
225.2g/mol
Monoisotopic Mass:
225.064g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
98.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties