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Home Carboxys 2H-Pyran-2-carboxylic acid, 3,4-dihydro-,(3,4-dihydro-2H-pyran-2-yl)methyl ester

2H-Pyran-2-carboxylic acid, 3,4-dihydro-,(3,4-dihydro-2H-pyran-2-yl)methyl ester

CAS No.:
3540-36-1
Catalog Number:
AG01FOJK
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$98
- +
5g
1 week
United States
$216
- +
10g
1 week
United States
$234
- +
Product Description
Catalog Number:
AG01FOJK
Chemical Name:
2H-Pyran-2-carboxylic acid, 3,4-dihydro-,(3,4-dihydro-2H-pyran-2-yl)methyl ester
CAS Number:
3540-36-1
Molecular Formula:
C12H16O4
Molecular Weight:
224.2530
MDL Number:
MFCD00023813
IUPAC Name:
3,4-dihydro-2H-pyran-2-ylmethyl 3,4-dihydro-2H-pyran-2-carboxylate
InChI:
InChI=1S/C12H16O4/c13-12(11-6-2-4-8-15-11)16-9-10-5-1-3-7-14-10/h3-4,7-8,10-11H,1-2,5-6,9H2
InChI Key:
OPRHFGGPAJOHSF-UHFFFAOYSA-N
SMILES:
O=C(C1CCC=CO1)OCC1CCC=CO1
EC Number:
222-582-7
NSC Number:
38983
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.256g/mol
Monoisotopic Mass:
224.105g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties