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Home Carboxys Methyl 1-oxo-1,2,3,4-tetrahydronaphthalene-2-carboxylate

Methyl 1-oxo-1,2,3,4-tetrahydronaphthalene-2-carboxylate

CAS No.:
7442-52-6
Catalog Number:
AG003A0D
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$42
- +
5g
95%
In Stock USA
United States
$158
- +
10g
95%
In Stock USA
United States
$292
- +
Product Description
Catalog Number:
AG003A0D
Chemical Name:
Methyl 1-oxo-1,2,3,4-tetrahydronaphthalene-2-carboxylate
CAS Number:
7442-52-6
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
MDL Number:
MFCD00667560
IUPAC Name:
methyl 1-oxo-3,4-dihydro-2H-naphthalene-2-carboxylate
InChI:
InChI=1S/C12H12O3/c1-15-12(14)10-7-6-8-4-2-3-5-9(8)11(10)13/h2-5,10H,6-7H2,1H3
InChI Key:
YDDRYTDEKAPAHE-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCc2c(C1=O)cccc2
NSC Number:
401457
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.225g/mol
Monoisotopic Mass:
204.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties