Home Other Building Blocks METHYL 2-HYDROXY-2-(NAPHTHALEN-1-YL)ACETATE

METHYL 2-HYDROXY-2-(NAPHTHALEN-1-YL)ACETATE

CAS No.:
78772-53-9
Catalog Number:
AG01EMH5
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
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Product Description
Catalog Number:
AG01EMH5
Chemical Name:
METHYL 2-HYDROXY-2-(NAPHTHALEN-1-YL)ACETATE
CAS Number:
78772-53-9
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
MDL Number:
MFCD16723798
IUPAC Name:
methyl 2-hydroxy-2-naphthalen-1-ylacetate
InChI:
InChI=1S/C13H12O3/c1-16-13(15)12(14)11-8-4-6-9-5-2-3-7-10(9)11/h2-8,12,14H,1H3
InChI Key:
MLGAFFCIJKBSBD-UHFFFAOYSA-N
SMILES:
COC(=O)C(c1cccc2c1cccc2)O
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.079g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.236g/mol
Monoisotopic Mass:
216.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties