Home Other Building Blocks 2-HYDROXY-INDAN-2-CARBOXYLIC ACID METHYL ESTER

2-HYDROXY-INDAN-2-CARBOXYLIC ACID METHYL ESTER

CAS No.:
1249067-50-2
Catalog Number:
AG01DV3W
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
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Product Description
Catalog Number:
AG01DV3W
Chemical Name:
2-HYDROXY-INDAN-2-CARBOXYLIC ACID METHYL ESTER
CAS Number:
1249067-50-2
Molecular Formula:
C11H12O3
Molecular Weight:
192.2112
MDL Number:
MFCD16693852
IUPAC Name:
methyl 2-hydroxy-1,3-dihydroindene-2-carboxylate
InChI:
InChI=1S/C11H12O3/c1-14-10(12)11(13)6-8-4-2-3-5-9(8)7-11/h2-5,13H,6-7H2,1H3
InChI Key:
VPSYNMGLTQRKGM-UHFFFAOYSA-N
SMILES:
COC(=O)C1(O)Cc2c(C1)cccc2
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.214g/mol
Monoisotopic Mass:
192.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties