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81887-68-5

81887-68-5 | METHYL 5-(ACETYLAMINO)-2-HYDROXYBENZOATE

CAS No: 81887-68-5 Catalog No: AG005H0H MDL No:MFCD02330782

Product Description

Catalog Number:
AG005H0H
Chemical Name:
METHYL 5-(ACETYLAMINO)-2-HYDROXYBENZOATE
CAS Number:
81887-68-5
Molecular Formula:
C10H11NO4
Molecular Weight:
209.1986
MDL Number:
MFCD02330782
IUPAC Name:
methyl 5-acetamido-2-hydroxybenzoate
InChI:
InChI=1S/C10H11NO4/c1-6(12)11-7-3-4-9(13)8(5-7)10(14)15-2/h3-5,13H,1-2H3,(H,11,12)
InChI Key:
JOILLVHUXHWRQB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(ccc1O)NC(=O)C

Properties

Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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