Home Other Building Blocks methyl 2-(5-hydroxynaphthalen-1-yl)acetate

methyl 2-(5-hydroxynaphthalen-1-yl)acetate

CAS No.:
497068-60-7
Catalog Number:
AG01AUBJ
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
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Product Description
Catalog Number:
AG01AUBJ
Chemical Name:
methyl 2-(5-hydroxynaphthalen-1-yl)acetate
CAS Number:
497068-60-7
Molecular Formula:
C13H12O3
Molecular Weight:
216.2326
MDL Number:
MFCD18417655
IUPAC Name:
methyl 2-(5-hydroxynaphthalen-1-yl)acetate
InChI:
InChI=1S/C13H12O3/c1-16-13(15)8-9-4-2-6-11-10(9)5-3-7-12(11)14/h2-7,14H,8H2,1H3
InChI Key:
SOCVVRZXQHVOHS-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1cccc2c1cccc2O
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties